Vitas-M small molecule compound
N-(3,4-dimethylphenyl)-2-(4-methyl-5-{[(4-oxo-3,4-dihydroquinazolin-2-yl)methyl]sulfanyl}-4H-1,2,4-triazol-3-yl)acetamide
Catalog ID
STK218558
SMILES O=C(Cc1nnc(n1C)SCc1nc2ccccc2c(=O)[nH]1)Nc1ccc(c(c1)C)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 C22H22N6O2S MW 434.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22N6O2S/c1-13-8-9-15(10-14(13)2)23-20(29)11-19-26-27-22(28(19)3)31-12-18-24-17-7-5-4-6-16(17)21(30)25-18/h4-10H,11-12H2,1-3H3,(H,23,29)(H,24,25,30)InChIKey
OGCVEYRRZGCMPL-UHFFFAOYSA-NSynonyms
CC1=C(C=C(C=C1)NC(=O)CC2=NN=C(N2C)SCC3=NC(=O)C4=CC=CC=C4N3)C
InChI=1SC22H22N6O2Sc1138915(1014(13)2)2320(29)1119262722(28(19)3)3112182417754616(17)21(30)2518h410H1112H213H3(H2329)(H242530)
MFCD07189273
N(34DIMETHYLPHENYL)2(4METHYL5(((4OXO34DIHYDROQUINAZOLIN2YL)METHYL)SULFANYL)4H124TRIAZOL3YL)ACETAMIDE
N(34DIMETHYLPHENYL)2(4METHYL5((4OXO1HQUINAZOLIN2YL)METHYLSULFANYL)124TRIAZOL3YL)ACETAMIDE
O=C(Cc1nnc(n1C)SCc1nc2ccccc2c(=O)(nH)1)Nc1ccc(c(c1)C)C
ZINC000009262717
ZINC09262717
ZINC9262717
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