Vitas-M small molecule compound
4-methoxy-N-[2-(4-methyl-5-{[(4-oxo-3,4-dihydroquinazolin-2-yl)methyl]sulfanyl}-4H-1,2,4-triazol-3-yl)ethyl]benzamide
Catalog ID
STK219219
SMILES COc1ccc(cc1)C(=O)NCCc1nnc(n1C)SCc1nc2ccccc2c(=O)[nH]1
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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 C22H22N6O3S MW 450.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22N6O3S/c1-28-19(11-12-23-20(29)14-7-9-15(31-2)10-8-14)26-27-22(28)32-13-18-24-17-6-4-3-5-16(17)21(30)25-18/h3-10H,11-13H2,1-2H3,(H,23,29)(H,24,25,30)InChIKey
AXFLTEFECLWZKV-UHFFFAOYSA-NSynonyms
4METHOXYN(2(4METHYL5(((4OXO34DIHYDRO2QUINAZOLINYL)METHYL)THIO)4H124TRIAZOL3YL)ETHYL)BENZAMIDE
4METHOXYN(2(4METHYL5(((4OXO34DIHYDROQUINAZOLIN2YL)METHYL)SULFANYL)4H124TRIAZOL3YL)ETHYL)BENZAMIDE
4METHOXYN(2(4METHYL5((4OXO1HQUINAZOLIN2YL)METHYLSULFANYL)124TRIAZOL3YL)ETHYL)BENZAMIDE
CN1C(=NN=C1SCC2=NC(=O)C3=CC=CC=C3N2)CCNC(=O)C4=CC=C(C=C4)OC
COc1ccc(cc1)C(=O)NCCc1nnc(n1C)SCc1nc2ccccc2c(=O)(nH)1
InChI=1SC22H22N6O3Sc12819(11122320(29)147915(312)10814)262722(28)3213182417643516(17)21(30)2518h310H1113H212H3(H2329)(H242530)
MFCD06006901
ZINC000008584504
ZINC08584504
ZINC8584504
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