Vitas-M small molecule compound
7-({[4-chloro-3-(difluoromethyl)-5-methyl-1H-pyrazol-1-yl]acetyl}amino)-3-{[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]methyl}-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
Catalog ID
STL405666
SMILES Cc1nnc(s1)SCC1=C(C(=O)O)N2C(SC1)C(C2=O)NC(=O)Cn1nc(c(c1C)Cl)C(F)F
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C18H17ClF2N6O4S3 MW 551.02 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H17ClF2N6O4S3/c1-6-10(19)11(14(20)21)25-26(6)3-9(28)22-12-15(29)27-13(17(30)31)8(4-32-16(12)27)5-33-18-24-23-7(2)34-18/h12,14,16H,3-5H2,1-2H3,(H,22,28)(H,30,31)InChIKey
UKYSLASHEMIDQU-UHFFFAOYSA-NSynonyms
1214164-94-91214164949
7(((4chloro3(difluoromethyl)5methyl1Hpyrazol1yl)acetyl)amino)3(((5methyl134thiadiazol2yl)sulfanyl)methyl)8oxo5thia1azabicyclo(420)oct2ene2carboxylicacid
7(((4CHLORO3(DIFLUOROMETHYL)5METHYL1HPYRAZOL1YL)ACETYL)AMINO)3(((5METHYL134THIADIAZOL2YL)THIO)METHYL)8OXO5THIA1AZABICYCLO(420)OCT2ENE2CARBOXYLICACID
7((2(4CHLORO3(DIFLUOROMETHYL)5METHYL1PYRAZOLYL)1OXOETHYL)AMINO)3(((5METHYL134THIADIAZOL2YL)THIO)METHYL)8OXO5THIA1AZABICYCLO(420)OCT2ENE2CARBOXYLICACID
7((2(4CHLORO3(DIFLUOROMETHYL)5METHYLPYRAZOL1YL)ACETYL)AMINO)3((5METHYL134THIADIAZOL2YL)SULFANYLMETHYL)8OXO5THIA1AZABICYCLO(420)OCT2ENE2CARBOXYLICACID
7((2(4CHLORO3(DIFLUOROMETHYL)5METHYLPYRAZOL1YL)ACETYL)AMINO)8KETO3(((5METHYL134THIADIAZOL2YL)THIO)METHYL)5THIA1AZABICYCLO(420)OCT2ENE2CARBOXYLICACID
7(2(3(BIS(FLUORANYL)METHYL)4CHLORANYL5METHYLPYRAZOL1YL)ETHANOYLAMINO)3((5METHYL134THIADIAZOL2YL)SULFANYLMETHYL)8OXIDANYLIDENE5THIA1AZABICYCLO(420)OCT2ENE2CARBOXYLICACID
CC1=C(C(=NN1CC(=O)NC2C3N(C2=O)C(=C(CS3)CSC4=NN=C(S4)C)C(=O)O)C(F)F)Cl
InChI=1SC18H17ClF2N6O4S3c1610(19)11(14(20)21)2526(6)39(28)221215(29)2713(17(30)31)8(43216(12)27)5331824237(2)3418h121416H35H212H3(H2228)(H3031)
MFCD05667303
ZINC000002732812
ZINC000002732815
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