N-(3-cyanophenyl)-4-phenethyl-piperazine-1-carbothioamide

Systemtic Name: N-(3-cyanophenyl)-4-phenethyl-piperazine-1-carbothioamide Openeye Name: N-(3-cyanophenyl)-4-phenethyl-piperazine-1-carbothioamide CAS Name: N-(3-cyanophenyl)-4-phenethyl-1-piperazinecarbothioamide IUPAC Name: N-(3-cyanophenyl)-4-phenethylpiperazine-1-carbothioamide Traditional Name: N-(3-cyanophenyl)-4-phenethyl-piperazine-1-carbothioamide Formula: C20H22N4S MolecularWeight: 350.48048

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCC2=CC=CC=C2)C(=S)NC3=CC=CC(=C3)C#N

Isomeric SMILES

C1CN(CCN1CCC2=CC=CC=C2)C(=S)NC3=CC=CC(=C3)C#N

InChI

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