Vitas-M small molecule compound
N-(2-methoxyphenyl)-5-methyl-2-[(4-methylbenzyl)sulfanyl]-7-phenyl-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide
Catalog ID
STL200403
SMILES COc1ccccc1NC(=O)C1=C(C)Nc2n(C1c1ccccc1)nc(n2)SCc1ccc(cc1)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 C28H27N5O2S MW 497.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H27N5O2S/c1-18-13-15-20(16-14-18)17-36-28-31-27-29-19(2)24(25(33(27)32-28)21-9-5-4-6-10-21)26(34)30-22-11-7-8-12-23(22)35-3/h4-16,25H,17H2,1-3H3,(H,30,34)(H,29,31,32)InChIKey
RFDZRLBGDDFXPT-UHFFFAOYSA-NSynonyms
CC1=CC=C(C=C1)CSC2=NC3=NC(=C(C(N3N2)C4=CC=CC=C4)C(=O)NC5=CC=CC=C5OC)C
InChI=1SC28H27N5O2Sc118131520(161418)17362831272919(2)24(25(33(27)3228)2195461021)26(34)302211781223(22)353h41625H17H213H3(H3034)(H293132)
MFCD24858187
N(2methoxyphenyl)5methyl2((4methylbenzyl)sulfanyl)7phenyl47dihydro(124)triazolo(15a)pyrimidine6carboxamide
N(2methoxyphenyl)5methyl2((4methylphenyl)methylsulfanyl)7phenyl17dihydro(124)triazolo(15a)pyrimidine6carboxamide
ZINC000080325134
ZINC000080325139
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