Vitas-M small molecule compound

2-[(4-benzylpiperidin-1-yl)methyl]-5-(4-methylphenyl)-4-phenyl-2,4-dihydro-3H-1,2,4-triazole-3-thione

Catalog ID
STK015134
SMILES Cc1ccc(cc1)c1nn(c(=S)n1c1ccccc1)CN1CCC(CC1)Cc1ccccc1

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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 C28H30N4S MW 454.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H30N4S/c1-22-12-14-25(15-13-22)27-29-31(28(33)32(27)26-10-6-3-7-11-26)21-30-18-16-24(17-19-30)20-23-8-4-2-5-9-23/h2-15,24H,16-21H2,1H3
InChIKey
FCXSKWVWZUXSSJ-UHFFFAOYSA-N
Synonyms

2((4BENZYLPIPERIDIN1YL)METHYL)5(4METHYLPHENYL)4PHENYL124TRIAZOLE3THIONE
2((4BENZYLPIPERIDIN1YL)METHYL)5(4METHYLPHENYL)4PHENYL24DIHYDRO3H124TRIAZOLE3THIONE
CC1=CC=C(C=C1)C2=NN(C(=S)N2C3=CC=CC=C3)CN4CCC(CC4)CC5=CC=CC=C5
Cc1ccc(cc1)c1nn(c(=S)n1c1ccccc1)CN1CCC(CC1)Cc1ccccc1
InChI=1SC28H30N4Sc122121425(151322)272931(28(33)32(27)26106371126)2130181624(171930)20238425923h21524H1621H21H3
MFCD03195704
STK015134
ZINC000008986030
ZINC8986030

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Available files

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