Vitas-M small molecule compound
N-(1,3-dimethyl-2-oxo-2,3-dihydro-1H-benzimidazol-5-yl)-2-{[5-ethyl-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Catalog ID
STK251391
SMILES C=CCn1c(SCC(=O)Nc2ccc3c(c2)n(C)c(=O)n3C)nnc1CC
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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 C18H22N6O2S MW 386.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H22N6O2S/c1-5-9-24-15(6-2)20-21-17(24)27-11-16(25)19-12-7-8-13-14(10-12)23(4)18(26)22(13)3/h5,7-8,10H,1,6,9,11H2,2-4H3,(H,19,25)InChIKey
COSMIQMZSGSGFE-UHFFFAOYSA-NSynonyms
2(4ALLYL5ETHYL4H(124)TRIAZOL3YLSULFANYL)N(13DIMETHYL2OXO23DIHYDRO1HBENZOIMIDAZOL5YL)ACETAMIDE
CCC1=NN=C(N1CC=C)SCC(=O)NC2=CC3=C(C=C2)N(C(=O)N3C)C
InChI=1SC18H22N6O2Sc1592415(62)202117(24)271116(25)1912781314(1012)23(4)18(26)22(13)3h57810H16911H224H3(H1925)
MFCD08670784
N(13DIMETHYL2OXO23DIHYDRO1HBENZIMIDAZOL5YL)2((5ETHYL4(PROP2EN1YL)4H124TRIAZOL3YL)SULFANYL)ACETAMIDE
N(13dimethyl2oxobenzimidazol5yl)2((5ethyl4prop2enyl124triazol3yl)sulfanyl)acetamide
ZINC000009699331
ZINC09699331
ZINC9699331
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