6-(4-chlorophenyl)sulfanyl-5-methyl-2-(3-nitrophenyl)-3-oxidanylidene-pyridazine-4-carbonitrile

Systemtic Name: 6-(4-chlorophenyl)sulfanyl-5-methyl-2-(3-nitrophenyl)-3-oxidanylidene-pyridazine-4-carbonitrile Openeye Name: 6-(4-chlorophenyl)sulfanyl-5-methyl-2-(3-nitrophenyl)-3-oxo-pyridazine-4-carbonitrile CAS Name: 6-[(4-chlorophenyl)thio]-5-methyl-2-(3-nitrophenyl)-3-oxo-4-pyridazinecarbonitrile IUPAC Name: 6-(4-chlorophenyl)sulfanyl-5-methyl-2-(3-nitrophenyl)-3-oxopyridazine-4-carbonitrile Traditional Name: 6-[(4-chlorophenyl)thio]-3-keto-5-methyl-2-(3-nitrophenyl)pyridazine-4-carbonitrile Formula: C18H11ClN4O3S MolecularWeight: 398.82294

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N=C1SC2=CC=C(C=C2)Cl)C3=CC(=CC=C3)[N+](=O)[O-])C#N

Isomeric SMILES

CC1=C(C(=O)N(N=C1SC2=CC=C(C=C2)Cl)C3=CC(=CC=C3)[N+](=O)[O-])C#N

InChI

InChI=1S/C18H11ClN4O3S/c1-11-16(10-20)18(24)22(13-3-2-4-14(9-13)23(25)26)21-17(11)27-15-7-5-12(19)6-8-15/h2-9H,1H3