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

Systemtic Name: [4-(3-chlorophenyl)piperazin-1-yl]-(3,4-diethoxyphenyl)methanethione Openeye Name: [4-(3-chlorophenyl)piperazin-1-yl]-(3,4-diethoxyphenyl)methanethione CAS Name: [4-(3-chlorophenyl)-1-piperazinyl]-(3,4-diethoxyphenyl)methanethione IUPAC Name: [4-(3-chlorophenyl)piperazin-1-yl]-(3,4-diethoxyphenyl)methanethione Traditional Name: [4-(3-chlorophenyl)piperazino]-(3,4-diethoxyphenyl)methanethione Formula: C21H25ClN2O2S MolecularWeight: 404.9534

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(=S)N2CCN(CC2)C3=CC(=CC=C3)Cl)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(=S)N2CCN(CC2)C3=CC(=CC=C3)Cl)OCC

InChI

InChI=1S/C21H25ClN2O2S/c1-3-25-19-9-8-16(14-20(19)26-4-2)21(27)24-12-10-23(11-13-24)18-7-5-6-17(22)15-18/h5-9,14-15H,3-4,10-13H2,1-2H3