4-(3,5-dimethylphenyl)sulfanyl-3-nitro-1H-quinolin-2-one

Systemtic Name: 4-(3,5-dimethylphenyl)sulfanyl-3-nitro-1H-quinolin-2-one Openeye Name: 4-(3,5-dimethylphenyl)sulfanyl-3-nitro-1H-quinolin-2-one CAS Name: 4-[(3,5-dimethylphenyl)thio]-3-nitro-1H-quinolin-2-one IUPAC Name: 4-(3,5-dimethylphenyl)sulfanyl-3-nitro-1H-quinolin-2-one Traditional Name: 4-[(3,5-dimethylphenyl)thio]-3-nitro-carbostyril Formula: C17H14N2O3S MolecularWeight: 326.36966

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)SC2=C(C(=O)NC3=CC=CC=C32)[N+](=O)[O-])C

Isomeric SMILES

CC1=CC(=CC(=C1)SC2=C(C(=O)NC3=CC=CC=C32)[N+](=O)[O-])C

InChI

InChI=1S/C17H14N2O3S/c1-10-7-11(2)9-12(8-10)23-16-13-5-3-4-6-14(13)18-17(20)15(16)19(21)22/h3-9H,1-2H3,(H,18,20)