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

Systemtic Name: 2-(4-chlorophenyl)-5,6-dihydro-[1]benzothiepino[5,4-c]pyridazin-3-one Openeye Name: 2-(4-chlorophenyl)-5,6-dihydro-[1]benzothiepino[5,4-c]pyridazin-3-one CAS Name: 2-(4-chlorophenyl)-5,6-dihydro-[1]benzothiepino[5,4-c]pyridazin-3-one IUPAC Name: 2-(4-chlorophenyl)-5,6-dihydro-[1]benzothiepino[5,4-c]pyridazin-3-one Traditional Name: 2-(4-chlorophenyl)-5,6-dihydro-[1]benzothiepino[5,4-c]pyridazin-3-one Formula: C18H13ClN2OS MolecularWeight: 340.82662

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Descriptors Computed from Structure

Canonical SMILES:

C1CSC2=CC=CC=C2C3=NN(C(=O)C=C31)C4=CC=C(C=C4)Cl

Isomeric SMILES

C1CSC2=CC=CC=C2C3=NN(C(=O)C=C31)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C18H13ClN2OS/c19-13-5-7-14(8-6-13)21-17(22)11-12-9-10-23-16-4-2-1-3-15(16)18(12)20-21/h1-8,11H,9-10H2