Vitas-M small molecule compound
N-(2-methoxyphenyl)-5-methyl-7-[4-(methylsulfanyl)phenyl]-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide
Catalog ID
STK174963
SMILES COc1ccccc1NC(=O)C1=C(C)Nc2n(C1c1ccc(cc1)SC)ncn2
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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 C21H21N5O2S MW 407.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21N5O2S/c1-13-18(20(27)25-16-6-4-5-7-17(16)28-2)19(26-21(24-13)22-12-23-26)14-8-10-15(29-3)11-9-14/h4-12,19H,1-3H3,(H,25,27)(H,22,23,24)InChIKey
WRQGPGRUYWMPKQ-UHFFFAOYSA-NSynonyms
CC1=C(C(N2C(=N1)N=CN2)C3=CC=C(C=C3)SC)C(=O)NC4=CC=CC=C4OC
InChI=1SC21H21N5O2Sc11318(20(27)2516645717(16)282)19(2621(2413)22122326)1481015(293)11914h41219H13H3(H2527)(H222324)
MFCD06757514
N(2METHOXYPHENYL)5METHYL7(4(METHYLSULFANYL)PHENYL)47DIHYDRO(124)TRIAZOLO(15A)PYRIMIDINE6CARBOXAMIDE
N(2methoxyphenyl)5methyl7(4methylsulfanylphenyl)17dihydro(124)triazolo(15a)pyrimidine6carboxamide
ZINC000004704195
ZINC000004704196
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