N-[(3,4-dichlorophenyl)methyl]-4-(3-phenylprop-2-enyl)piperazine-1-carbothioamide

Systemtic Name: N-[(3,4-dichlorophenyl)methyl]-4-(3-phenylprop-2-enyl)piperazine-1-carbothioamide Openeye Name: 4-cinnamyl-N-[(3,4-dichlorophenyl)methyl]piperazine-1-carbothioamide CAS Name: N-[(3,4-dichlorophenyl)methyl]-4-(3-phenylprop-2-enyl)-1-piperazinecarbothioamide IUPAC Name: N-[(3,4-dichlorophenyl)methyl]-4-(3-phenylprop-2-enyl)piperazine-1-carbothioamide Traditional Name: 4-cinnamyl-N-(3,4-dichlorobenzyl)piperazine-1-carbothioamide Formula: C21H23Cl2N3S MolecularWeight: 420.39842

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC=CC2=CC=CC=C2)C(=S)NCC3=CC(=C(C=C3)Cl)Cl

Isomeric SMILES

C1CN(CCN1CC=CC2=CC=CC=C2)C(=S)NCC3=CC(=C(C=C3)Cl)Cl

InChI

InChI=1S/C21H23Cl2N3S/c22-19-9-8-18(15-20(19)23)16-24-21(27)26-13-11-25(12-14-26)10-4-7-17-5-2-1-3-6-17/h1-9,15H,10-14,16H2,(H,24,27)