Vitas-M small molecule compound
7-{[(2,4-dimethylphenyl)carbonyl]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
STL177494
SMILES Cc1ccc(c(c1)C)C(=O)NC1C(=O)N2C1SCC(=C2C(=O)O)CSc1nnc(s1)C
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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 C20H20N4O4S3 MW 476.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H20N4O4S3/c1-9-4-5-13(10(2)6-9)16(25)21-14-17(26)24-15(19(27)28)12(7-29-18(14)24)8-30-20-23-22-11(3)31-20/h4-6,14,18H,7-8H2,1-3H3,(H,21,25)(H,27,28)InChIKey
GNZSIDMQDBZOPF-UHFFFAOYSA-NSynonyms
1214120-88-31214120883
7(((24dimethylphenyl)carbonyl)amino)3(((5methyl134thiadiazol2yl)sulfanyl)methyl)8oxo5thia1azabicyclo(420)oct2ene2carboxylicacid
7((24dimethylbenzoyl)amino)3((5methyl134thiadiazol2yl)sulfanylmethyl)8oxo5thia1azabicyclo(420)oct2ene2carboxylicacid
CC1=CC(=C(C=C1)C(=O)NC2C3N(C2=O)C(=C(CS3)CSC4=NN=C(S4)C)C(=O)O)C
InChI=1SC20H20N4O4S3c194513(10(2)69)16(25)211417(26)2415(19(27)28)12(72918(14)24)83020232211(3)3120h461418H78H213H3(H2125)(H2728)
MFCD04054112
ZINC000002805534
ZINC000002805537
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