2-[(2-chloranyl-7-methylsulfanyl-quinolin-3-yl)methyl]-5,6-dimethyl-3-oxidanylidene-pyridazine-4-carbonitrile

Systemtic Name: 2-[(2-chloranyl-7-methylsulfanyl-quinolin-3-yl)methyl]-5,6-dimethyl-3-oxidanylidene-pyridazine-4-carbonitrile Openeye Name: 2-[(2-chloro-7-methylsulfanyl-3-quinolyl)methyl]-5,6-dimethyl-3-oxo-pyridazine-4-carbonitrile CAS Name: 2-[[2-chloro-7-(methylthio)-3-quinolinyl]methyl]-5,6-dimethyl-3-oxo-4-pyridazinecarbonitrile IUPAC Name: 2-[(2-chloro-7-methylsulfanylquinolin-3-yl)methyl]-5,6-dimethyl-3-oxopyridazine-4-carbonitrile Traditional Name: 2-[[2-chloro-7-(methylthio)-3-quinolyl]methyl]-3-keto-5,6-dimethyl-pyridazine-4-carbonitrile Formula: C18H15ClN4OS MolecularWeight: 370.8559

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N=C1C)CC2=C(N=C3C=C(C=CC3=C2)SC)Cl)C#N

Isomeric SMILES

CC1=C(C(=O)N(N=C1C)CC2=C(N=C3C=C(C=CC3=C2)SC)Cl)C#N

InChI

InChI=1S/C18H15ClN4OS/c1-10-11(2)22-23(18(24)15(10)8-20)9-13-6-12-4-5-14(25-3)7-16(12)21-17(13)19/h4-7H,9H2,1-3H3