Vitas-M small molecule compound
2-(benzylsulfanyl)-N-(4-methoxyphenyl)-5-methyl-7-(4-methylphenyl)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide
Catalog ID
STK884353
SMILES COc1ccc(cc1)NC(=O)C1=C(C)Nc2n(C1c1ccc(cc1)C)nc(n2)SCc1ccccc1
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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 C28H27N5O2S MW 497.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H27N5O2S/c1-18-9-11-21(12-10-18)25-24(26(34)30-22-13-15-23(35-3)16-14-22)19(2)29-27-31-28(32-33(25)27)36-17-20-7-5-4-6-8-20/h4-16,25H,17H2,1-3H3,(H,30,34)(H,29,31,32)InChIKey
RCGADWKOYSYBAG-UHFFFAOYSA-NSynonyms
2(benzylsulfanyl)N(4methoxyphenyl)5methyl7(4methylphenyl)47dihydro(124)triazolo(15a)pyrimidine6carboxamide
2benzylsulfanylN(4methoxyphenyl)5methyl7(4methylphenyl)17dihydro(124)triazolo(15a)pyrimidine6carboxamide
CC1=CC=C(C=C1)C2C(=C(N=C3N2NC(=N3)SCC4=CC=CC=C4)C)C(=O)NC5=CC=C(C=C5)OC
InChI=1SC28H27N5O2Sc11891121(121018)2524(26(34)3022131523(353)161422)19(2)29273128(3233(25)27)3617207546820h41625H17H213H3(H3034)(H293132)
MFCD14980607
ZINC000020984629
ZINC000020984632
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