Vitas-M small molecule compound
4-(4-{[(5-amino-1,3,4-thiadiazol-2-yl)sulfanyl]methyl}-5-methylthiophen-2-yl)-2-methyl-5-oxo-N-phenyl-1,4,5,6,7,8-hexahydroquinoline-3-carboxamide
Catalog ID
STK783441
SMILES Nc1nnc(s1)SCc1cc(sc1C)C1C(=C(C)NC2=C1C(=O)CCC2)C(=O)Nc1ccccc1
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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 C25H25N5O2S3 MW 523.70 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H25N5O2S3/c1-13-20(23(32)28-16-7-4-3-5-8-16)22(21-17(27-13)9-6-10-18(21)31)19-11-15(14(2)34-19)12-33-25-30-29-24(26)35-25/h3-5,7-8,11,22,27H,6,9-10,12H2,1-2H3,(H2,26,29)(H,28,32)InChIKey
AUIIZLJHYBBTRF-UHFFFAOYSA-NSynonyms
4(4(((5amino134thiadiazol2yl)sulfanyl)methyl)5methylthiophen2yl)2methyl5oxoNphenyl145678hexahydroquinoline3carboxamide
4(4((5amino134thiadiazol2yl)sulfanylmethyl)5methylthiophen2yl)2methyl5oxoNphenyl4678tetrahydro1Hquinoline3carboxamide
CC1=C(C(C2=C(N1)CCCC2=O)C3=CC(=C(S3)C)CSC4=NN=C(S4)N)C(=O)NC5=CC=CC=C5
InChI=1SC25H25N5O2S3c11320(23(32)28167435816)22(2117(2713)961018(21)31)191115(14(2)3419)123325302924(26)3525h3578112227H691012H212H3(H22629)(H2832)
MFCD06618235
ZINC000012372417
ZINC000012372418
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