3-[4-(3-chlorophenyl)piperazin-1-yl]-6-methoxy-thiochromen-4-one

Systemtic Name: 3-[4-(3-chlorophenyl)piperazin-1-yl]-6-methoxy-thiochromen-4-one Openeye Name: 3-[4-(3-chlorophenyl)piperazin-1-yl]-6-methoxy-thiochromen-4-one CAS Name: 3-[4-(3-chlorophenyl)-1-piperazinyl]-6-methoxy-1-benzothiopyran-4-one IUPAC Name: 3-[4-(3-chlorophenyl)piperazin-1-yl]-6-methoxythiochromen-4-one Traditional Name: 3-[4-(3-chlorophenyl)piperazino]-6-methoxy-thiochromen-4-one Formula: C20H19ClN2O2S MolecularWeight: 386.89506

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)SC=C(C2=O)N3CCN(CC3)C4=CC(=CC=C4)Cl

Isomeric SMILES

COC1=CC2=C(C=C1)SC=C(C2=O)N3CCN(CC3)C4=CC(=CC=C4)Cl

InChI

InChI=1S/C20H19ClN2O2S/c1-25-16-5-6-19-17(12-16)20(24)18(13-26-19)23-9-7-22(8-10-23)15-4-2-3-14(21)11-15/h2-6,11-13H,7-10H2,1H3