Vitas-M small molecule compound
5-methyl-2-[(4-methylbenzyl)sulfanyl]-N,7-diphenyl-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide
Catalog ID
STL200325
SMILES Cc1ccc(cc1)CSc1nn2c(n1)NC(=C(C2c1ccccc1)C(=O)Nc1ccccc1)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 C27H25N5OS MW 467.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H25N5OS/c1-18-13-15-20(16-14-18)17-34-27-30-26-28-19(2)23(25(33)29-22-11-7-4-8-12-22)24(32(26)31-27)21-9-5-3-6-10-21/h3-16,24H,17H2,1-2H3,(H,29,33)(H,28,30,31)InChIKey
WJAANTABULTMTR-UHFFFAOYSA-NSynonyms
5methyl2((4methylbenzyl)sulfanyl)N7diphenyl47dihydro(124)triazolo(15a)pyrimidine6carboxamide
5methyl2((4methylphenyl)methylsulfanyl)N7diphenyl17dihydro(124)triazolo(15a)pyrimidine6carboxamide
CC1=CC=C(C=C1)CSC2=NC3=NC(=C(C(N3N2)C4=CC=CC=C4)C(=O)NC5=CC=CC=C5)C
InChI=1SC27H25N5OSc118131520(161418)17342730262819(2)23(25(33)2922117481222)24(32(26)3127)2195361021h31624H17H212H3(H2933)(H283031)
MFCD24858140
ZINC000080324663
ZINC000080324670
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