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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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