2-(4-chlorophenyl)-9-methoxy-5,6-dihydro-[1]benzothiepino[5,4-c]pyridazin-3-one

Systemtic Name: 2-(4-chlorophenyl)-9-methoxy-5,6-dihydro-[1]benzothiepino[5,4-c]pyridazin-3-one Openeye Name: 2-(4-chlorophenyl)-9-methoxy-5,6-dihydro-[1]benzothiepino[5,4-c]pyridazin-3-one CAS Name: 2-(4-chlorophenyl)-9-methoxy-5,6-dihydro-[1]benzothiepino[5,4-c]pyridazin-3-one IUPAC Name: 2-(4-chlorophenyl)-9-methoxy-5,6-dihydro-[1]benzothiepino[5,4-c]pyridazin-3-one Traditional Name: 2-(4-chlorophenyl)-9-methoxy-5,6-dihydro-[1]benzothiepino[5,4-c]pyridazin-3-one Formula: C19H15ClN2O2S MolecularWeight: 370.8526

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C3=NN(C(=O)C=C3CCS2)C4=CC=C(C=C4)Cl

Isomeric SMILES

COC1=CC2=C(C=C1)C3=NN(C(=O)C=C3CCS2)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C19H15ClN2O2S/c1-24-15-6-7-16-17(11-15)25-9-8-12-10-18(23)22(21-19(12)16)14-4-2-13(20)3-5-14/h2-7,10-11H,8-9H2,1H3