Vitas-M small molecule compound
2-[(2,4-dimethylbenzyl)sulfanyl]-N-(2-methoxyphenyl)-5-methyl-7-[4-(propan-2-yl)phenyl]-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide
Catalog ID
STK884344
SMILES COc1ccccc1NC(=O)C1=C(C)Nc2n(C1c1ccc(cc1)C(C)C)nc(n2)SCc1ccc(cc1C)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 C32H35N5O2S MW 553.73 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H35N5O2S/c1-19(2)23-13-15-24(16-14-23)29-28(30(38)34-26-9-7-8-10-27(26)39-6)22(5)33-31-35-32(36-37(29)31)40-18-25-12-11-20(3)17-21(25)4/h7-17,19,29H,18H2,1-6H3,(H,34,38)(H,33,35,36)InChIKey
GKTDHPSNUCKWDA-UHFFFAOYSA-NSynonyms
2((24dimethylbenzyl)sulfanyl)N(2methoxyphenyl)5methyl7(4(propan2yl)phenyl)47dihydro(124)triazolo(15a)pyrimidine6carboxamide
2((24dimethylphenyl)methylsulfanyl)N(2methoxyphenyl)5methyl7(4propan2ylphenyl)17dihydro(124)triazolo(15a)pyrimidine6carboxamide
CC1=CC(=C(C=C1)CSC2=NC3=NC(=C(C(N3N2)C4=CC=C(C=C4)C(C)C)C(=O)NC5=CC=CC=C5OC)C)C
InChI=1SC32H35N5O2Sc119(2)23131524(161423)2928(30(38)34269781027(26)396)22(5)33313532(3637(29)31)401825121120(3)1721(25)4h7171929H18H216H3(H3438)(H333536)
MFCD14731502
ZINC000101296791
ZINC000101296795
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