Vitas-M small molecule compound
2-[(1-benzyl-1H-tetrazol-5-yl)sulfanyl]-N-{2-[(2-oxo-2-{[4-(propan-2-yl)phenyl]amino}ethyl)sulfanyl]-1,3-benzothiazol-6-yl}acetamide
Catalog ID
STK675156
SMILES O=C(Nc1ccc2c(c1)sc(n2)SCC(=O)Nc1ccc(cc1)C(C)C)CSc1nnnn1Cc1ccccc1
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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 C28H27N7O2S3 MW 589.77 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H27N7O2S3/c1-18(2)20-8-10-21(11-9-20)29-26(37)17-39-28-31-23-13-12-22(14-24(23)40-28)30-25(36)16-38-27-32-33-34-35(27)15-19-6-4-3-5-7-19/h3-14,18H,15-17H2,1-2H3,(H,29,37)(H,30,36)InChIKey
OJFYBANLGGGFPI-UHFFFAOYSA-NSynonyms
2((1BENZYL1HTETRAZOL5YL)SULFANYL)N(2((2OXO2((4(PROPAN2YL)PHENYL)AMINO)ETHYL)SULFANYL)13BENZOTHIAZOL6YL)ACETAMIDE
2(1BENZYLTETRAZOL5YL)SULFANYLN(2(2OXO2(4PROPAN2YLANILINO)ETHYL)SULFANYL13BENZOTHIAZOL6YL)ACETAMIDE
CC(C)C1=CC=C(C=C1)NC(=O)CSC2=NC3=C(S2)C=C(C=C3)NC(=O)CSC4=NN=NN4CC5=CC=CC=C5
InChI=1SC28H27N7O2S3c118(2)2081021(11920)2926(37)1739283123131222(1424(23)4028)3025(36)16382732333435(27)15196435719h31418H1517H212H3(H2937)(H3036)
MFCD01572839
ZINC000098002694
ZINC98002694
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