phenyl-[4-[(4-phenyl-3-pyridin-3-yl-5-sulfanylidene-1,2,4-triazol-1-yl)methyl]piperazin-1-yl]methanone

Systemtic Name: phenyl-[4-[(4-phenyl-3-pyridin-3-yl-5-sulfanylidene-1,2,4-triazol-1-yl)methyl]piperazin-1-yl]methanone Openeye Name: phenyl-[4-[[4-phenyl-3-(3-pyridyl)-5-thioxo-1,2,4-triazol-1-yl]methyl]piperazin-1-yl]methanone CAS Name: phenyl-[4-[[4-phenyl-3-(3-pyridinyl)-5-sulfanylidene-1,2,4-triazol-1-yl]methyl]-1-piperazinyl]methanone IUPAC Name: phenyl-[4-[(4-phenyl-3-pyridin-3-yl-5-sulfanylidene-1,2,4-triazol-1-yl)methyl]piperazin-1-yl]methanone Traditional Name: phenyl-[4-[[4-phenyl-3-(3-pyridyl)-5-thioxo-1,2,4-triazol-1-yl]methyl]piperazino]methanone Formula: C25H24N6OS MolecularWeight: 456.56266

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CN2C(=S)N(C(=N2)C3=CN=CC=C3)C4=CC=CC=C4)C(=O)C5=CC=CC=C5

Isomeric SMILES

C1CN(CCN1CN2C(=S)N(C(=N2)C3=CN=CC=C3)C4=CC=CC=C4)C(=O)C5=CC=CC=C5

InChI

InChI=1S/C25H24N6OS/c32-24(20-8-3-1-4-9-20)29-16-14-28(15-17-29)19-30-25(33)31(22-11-5-2-6-12-22)23(27-30)21-10-7-13-26-18-21/h1-13,18H,14-17,19H2