Vitas-M small molecule compound
2-(4-methoxyphenyl)-1-{3-phenyl-5-[(thiophen-2-ylmethyl)amino]-1H-1,2,4-triazol-1-yl}ethanone
Catalog ID
STK211619
SMILES COc1ccc(cc1)CC(=O)n1nc(nc1NCc1cccs1)c1ccccc1
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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 C22H20N4O2S MW 404.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H20N4O2S/c1-28-18-11-9-16(10-12-18)14-20(27)26-22(23-15-19-8-5-13-29-19)24-21(25-26)17-6-3-2-4-7-17/h2-13H,14-15H2,1H3,(H,23,24,25)InChIKey
NQPXQSAHIDPOHQ-UHFFFAOYSA-NSynonyms
2(4METHOXYPHENYL)1(3PHENYL5((THIOPHEN2YLMETHYL)AMINO)1H124TRIAZOL1YL)ETHANONE
2(4METHOXYPHENYL)1(3PHENYL5(THIOPHEN2YLMETHYLAMINO)124TRIAZOL1YL)ETHANONE
COC1=CC=C(C=C1)CC(=O)N2C(=NC(=N2)C3=CC=CC=C3)NCC4=CC=CS4
InChI=1SC22H20N4O2Sc1281811916(101218)1420(27)2622(23151985132919)2421(2526)176324717h213H1415H21H3(H232425)
MFCD08671587
ZINC000004777272
ZINC04777272
ZINC4777272
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