Vitas-M small molecule compound
7-(3-chlorophenyl)-2-[(3-methoxybenzyl)sulfanyl]-5-methyl-N-(2-methylphenyl)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide
Catalog ID
STK884334
SMILES COc1cccc(c1)CSc1nn2c(n1)NC(=C(C2c1cccc(c1)Cl)C(=O)Nc1ccccc1C)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 C28H26ClN5O2S MW 532.07 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H26ClN5O2S/c1-17-8-4-5-13-23(17)31-26(35)24-18(2)30-27-32-28(37-16-19-9-6-12-22(14-19)36-3)33-34(27)25(24)20-10-7-11-21(29)15-20/h4-15,25H,16H2,1-3H3,(H,31,35)(H,30,32,33)InChIKey
ZLWQRJRMDDURGE-UHFFFAOYSA-NSynonyms
7(3chlorophenyl)2((3methoxybenzyl)sulfanyl)5methylN(2methylphenyl)47dihydro(124)triazolo(15a)pyrimidine6carboxamide
7(3chlorophenyl)2((3methoxyphenyl)methylsulfanyl)5methylN(2methylphenyl)17dihydro(124)triazolo(15a)pyrimidine6carboxamide
CC1=CC=CC=C1NC(=O)C2=C(N=C3N=C(NN3C2C4=CC(=CC=C4)Cl)SCC5=CC(=CC=C5)OC)C
InChI=1SC28H26ClN5O2Sc1178451323(17)3126(35)2418(2)30273228(371619961222(1419)363)3334(27)25(24)201071121(29)1520h41525H16H213H3(H3135)(H303233)
MFCD15075094
ZINC000102694832
ZINC000102694837
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