4-[(4-cyanophenyl)methyl]-N-(3-methoxyphenyl)piperazine-1-carbothioamide

Systemtic Name: 4-[(4-cyanophenyl)methyl]-N-(3-methoxyphenyl)piperazine-1-carbothioamide Openeye Name: 4-[(4-cyanophenyl)methyl]-N-(3-methoxyphenyl)piperazine-1-carbothioamide CAS Name: 4-[(4-cyanophenyl)methyl]-N-(3-methoxyphenyl)-1-piperazinecarbothioamide IUPAC Name: 4-[(4-cyanophenyl)methyl]-N-(3-methoxyphenyl)piperazine-1-carbothioamide Traditional Name: 4-(4-cyanobenzyl)-N-(3-methoxyphenyl)piperazine-1-carbothioamide Formula: C20H22N4OS MolecularWeight: 366.47988

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)NC(=S)N2CCN(CC2)CC3=CC=C(C=C3)C#N

Isomeric SMILES

COC1=CC=CC(=C1)NC(=S)N2CCN(CC2)CC3=CC=C(C=C3)C#N

InChI

InChI=1S/C20H22N4OS/c1-25-19-4-2-3-18(13-19)22-20(26)24-11-9-23(10-12-24)15-17-7-5-16(14-21)6-8-17/h2-8,13H,9-12,15H2,1H3,(H,22,26)