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

Systemtic Name: [4-[(3,4-diphenyl-5-sulfanylidene-1,2,4-triazol-1-yl)methyl]piperazin-1-yl]-phenyl-methanone Openeye Name: [4-[(3,4-diphenyl-5-thioxo-1,2,4-triazol-1-yl)methyl]piperazin-1-yl]-phenyl-methanone CAS Name: [4-[(3,4-diphenyl-5-sulfanylidene-1,2,4-triazol-1-yl)methyl]-1-piperazinyl]-phenylmethanone IUPAC Name: [4-[(3,4-diphenyl-5-sulfanylidene-1,2,4-triazol-1-yl)methyl]piperazin-1-yl]-phenylmethanone Traditional Name: [4-[(3,4-diphenyl-5-thioxo-1,2,4-triazol-1-yl)methyl]piperazino]-phenyl-methanone Formula: C26H25N5OS MolecularWeight: 455.5746

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H25N5OS/c32-25(22-12-6-2-7-13-22)29-18-16-28(17-19-29)20-30-26(33)31(23-14-8-3-9-15-23)24(27-30)21-10-4-1-5-11-21/h1-15H,16-20H2