1,3-benzodioxol-5-yl-[4-(4-chlorophenyl)piperazin-1-yl]methanethione

Systemtic Name: 1,3-benzodioxol-5-yl-[4-(4-chlorophenyl)piperazin-1-yl]methanethione Openeye Name: 1,3-benzodioxol-5-yl-[4-(4-chlorophenyl)piperazin-1-yl]methanethione CAS Name: 1,3-benzodioxol-5-yl-[4-(4-chlorophenyl)-1-piperazinyl]methanethione IUPAC Name: 1,3-benzodioxol-5-yl-[4-(4-chlorophenyl)piperazin-1-yl]methanethione Traditional Name: 1,3-benzodioxol-5-yl-[4-(4-chlorophenyl)piperazino]methanethione Formula: C18H17ClN2O2S MolecularWeight: 360.85778

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=C(C=C2)Cl)C(=S)C3=CC4=C(C=C3)OCO4

Isomeric SMILES

C1CN(CCN1C2=CC=C(C=C2)Cl)C(=S)C3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C18H17ClN2O2S/c19-14-2-4-15(5-3-14)20-7-9-21(10-8-20)18(24)13-1-6-16-17(11-13)23-12-22-16/h1-6,11H,7-10,12H2