6-[5-chloranyl-1-(4-methoxyphenyl)-6-oxidanylidene-pyridazin-4-yl]-2-pyrrol-1-yl-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carbonitrile

Systemtic Name: 6-[5-chloranyl-1-(4-methoxyphenyl)-6-oxidanylidene-pyridazin-4-yl]-2-pyrrol-1-yl-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carbonitrile Openeye Name: 6-[5-chloro-1-(4-methoxyphenyl)-6-oxo-pyridazin-4-yl]-2-pyrrol-1-yl-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carbonitrile CAS Name: 6-[5-chloro-1-(4-methoxyphenyl)-6-oxo-4-pyridazinyl]-2-(1-pyrrolyl)-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carbonitrile IUPAC Name: 6-[5-chloro-1-(4-methoxyphenyl)-6-oxopyridazin-4-yl]-2-pyrrol-1-yl-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carbonitrile Traditional Name: 6-[5-chloro-6-keto-1-(4-methoxyphenyl)pyridazin-4-yl]-2-pyrrol-1-yl-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carbonitrile Formula: C23H18ClN5O2S MolecularWeight: 463.93932

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2C(=O)C(=C(C=N2)N3CCC4=C(C3)SC(=C4C#N)N5C=CC=C5)Cl

Isomeric SMILES

COC1=CC=C(C=C1)N2C(=O)C(=C(C=N2)N3CCC4=C(C3)SC(=C4C#N)N5C=CC=C5)Cl

InChI

InChI=1S/C23H18ClN5O2S/c1-31-16-6-4-15(5-7-16)29-22(30)21(24)19(13-26-29)28-11-8-17-18(12-25)23(32-20(17)14-28)27-9-2-3-10-27/h2-7,9-10,13H,8,11,14H2,1H3