[4-(3-chlorophenyl)piperazin-1-yl]-[5-(4-methylphenyl)furan-2-yl]methanethione

Systemtic Name: [4-(3-chlorophenyl)piperazin-1-yl]-[5-(4-methylphenyl)furan-2-yl]methanethione Openeye Name: [4-(3-chlorophenyl)piperazin-1-yl]-[5-(p-tolyl)-2-furyl]methanethione CAS Name: [4-(3-chlorophenyl)-1-piperazinyl]-[5-(4-methylphenyl)-2-furanyl]methanethione IUPAC Name: [4-(3-chlorophenyl)piperazin-1-yl]-[5-(4-methylphenyl)furan-2-yl]methanethione Traditional Name: [4-(3-chlorophenyl)piperazino]-[5-(p-tolyl)-2-furyl]methanethione Formula: C22H21ClN2OS MolecularWeight: 396.93294

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CC=C(O2)C(=S)N3CCN(CC3)C4=CC(=CC=C4)Cl

Isomeric SMILES

CC1=CC=C(C=C1)C2=CC=C(O2)C(=S)N3CCN(CC3)C4=CC(=CC=C4)Cl

InChI

InChI=1S/C22H21ClN2OS/c1-16-5-7-17(8-6-16)20-9-10-21(26-20)22(27)25-13-11-24(12-14-25)19-4-2-3-18(23)15-19/h2-10,15H,11-14H2,1H3