Vitas-M small molecule compound
4-{[(1E,2E)-3-(2-methoxyphenyl)prop-2-en-1-ylidene]amino}-5-(4-methylphenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Catalog ID
STL149082
SMILES COc1ccccc1/C=C/C=N/n1c(=S)[nH]nc1c1ccc(cc1)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 C19H18N4OS MW 350.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H18N4OS/c1-14-9-11-16(12-10-14)18-21-22-19(25)23(18)20-13-5-7-15-6-3-4-8-17(15)24-2/h3-13H,1-2H3,(H,22,25)/b7-5+,20-13+InChIKey
LOFDWLBWXYICSC-AMYLNKINSA-NSynonyms
613230-66-34(((1E2E)3(2methoxyphenyl)prop2en1ylidene)amino)5(4methylphenyl)24dihydro3H124triazole3thione
4((E)((E)3(2METHOXYPHENYL)PROP2ENYLIDENE)AMINO)3(4METHYLPHENYL)1H124TRIAZOLE5THIONE
4((E)3(2METHOXYPHENYL)PROP2EN(E)YLIDENEAMINO)5PTOLYL4H(124)TRIAZOLE3THIOL
613230663
CC1=CC=C(C=C1)C2=NNC(=S)N2N=CC=CC3=CC=CC=C3OC
COc1ccccc1C=CC=Nn1c(=S)(nH)nc1c1ccc(cc1)C
InChI=1SC19H18N4OSc11491116(121014)18212219(25)23(18)20135715634817(15)242h313H12H3(H2225)b75+2013+
MFCD03801469
ZINC000002223786
ZINC4456254
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