N-(3,4-dichlorophenyl)-4-phenyl-piperazine-1-carbothioamide

Systemtic Name: N-(3,4-dichlorophenyl)-4-phenyl-piperazine-1-carbothioamide Openeye Name: N-(3,4-dichlorophenyl)-4-phenyl-piperazine-1-carbothioamide CAS Name: N-(3,4-dichlorophenyl)-4-phenyl-1-piperazinecarbothioamide IUPAC Name: N-(3,4-dichlorophenyl)-4-phenylpiperazine-1-carbothioamide Traditional Name: N-(3,4-dichlorophenyl)-4-phenyl-piperazine-1-carbothioamide Formula: C17H17Cl2N3S MolecularWeight: 366.30798

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=C2)C(=S)NC3=CC(=C(C=C3)Cl)Cl

Isomeric SMILES

C1CN(CCN1C2=CC=CC=C2)C(=S)NC3=CC(=C(C=C3)Cl)Cl

InChI

InChI=1S/C17H17Cl2N3S/c18-15-7-6-13(12-16(15)19)20-17(23)22-10-8-21(9-11-22)14-4-2-1-3-5-14/h1-7,12H,8-11H2,(H,20,23)