4-(4-cyanophenyl)-N-(2,5-dimethoxyphenyl)piperazine-1-carbothioamide

Systemtic Name: 4-(4-cyanophenyl)-N-(2,5-dimethoxyphenyl)piperazine-1-carbothioamide Openeye Name: 4-(4-cyanophenyl)-N-(2,5-dimethoxyphenyl)piperazine-1-carbothioamide CAS Name: 4-(4-cyanophenyl)-N-(2,5-dimethoxyphenyl)-1-piperazinecarbothioamide IUPAC Name: 4-(4-cyanophenyl)-N-(2,5-dimethoxyphenyl)piperazine-1-carbothioamide Traditional Name: 4-(4-cyanophenyl)-N-(2,5-dimethoxyphenyl)piperazine-1-carbothioamide Formula: C20H22N4O2S MolecularWeight: 382.47928

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H22N4O2S/c1-25-17-7-8-19(26-2)18(13-17)22-20(27)24-11-9-23(10-12-24)16-5-3-15(14-21)4-6-16/h3-8,13H,9-12H2,1-2H3,(H,22,27)