4-(4-cyanophenyl)-N-phenethyl-piperazine-1-carbothioamide

Systemtic Name: 4-(4-cyanophenyl)-N-phenethyl-piperazine-1-carbothioamide Openeye Name: 4-(4-cyanophenyl)-N-phenethyl-piperazine-1-carbothioamide CAS Name: 4-(4-cyanophenyl)-N-phenethyl-1-piperazinecarbothioamide IUPAC Name: 4-(4-cyanophenyl)-N-phenethylpiperazine-1-carbothioamide Traditional Name: 4-(4-cyanophenyl)-N-phenethyl-piperazine-1-carbothioamide Formula: C20H22N4S MolecularWeight: 350.48048

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=C(C=C2)C#N)C(=S)NCCC3=CC=CC=C3

Isomeric SMILES

C1CN(CCN1C2=CC=C(C=C2)C#N)C(=S)NCCC3=CC=CC=C3

InChI

InChI=1S/C20H22N4S/c21-16-18-6-8-19(9-7-18)23-12-14-24(15-13-23)20(25)22-11-10-17-4-2-1-3-5-17/h1-9H,10-15H2,(H,22,25)