3-azanyl-N-(3,4-dimethylphenyl)-7,7-dimethyl-5-oxidanylidene-6,8-dihydrothieno[2,3-b]quinoline-2-carboxamide

Systemtic Name: 3-azanyl-N-(3,4-dimethylphenyl)-7,7-dimethyl-5-oxidanylidene-6,8-dihydrothieno[2,3-b]quinoline-2-carboxamide Openeye Name: 3-amino-N-(3,4-dimethylphenyl)-7,7-dimethyl-5-oxo-6,8-dihydrothieno[2,3-b]quinoline-2-carboxamide CAS Name: 3-amino-N-(3,4-dimethylphenyl)-7,7-dimethyl-5-oxo-6,8-dihydrothieno[2,3-b]quinoline-2-carboxamide IUPAC Name: 3-amino-N-(3,4-dimethylphenyl)-7,7-dimethyl-5-oxo-6,8-dihydrothieno[2,3-b]quinoline-2-carboxamide Traditional Name: 3-amino-N-(3,4-dimethylphenyl)-5-keto-7,7-dimethyl-6,8-dihydrothieno[2,3-b]quinoline-2-carboxamide Formula: C22H23N3O2S MolecularWeight: 393.50192

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C2=C(C3=CC4=C(CC(CC4=O)(C)C)N=C3S2)N)C

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C2=C(C3=CC4=C(CC(CC4=O)(C)C)N=C3S2)N)C

InChI

InChI=1S/C22H23N3O2S/c1-11-5-6-13(7-12(11)2)24-20(27)19-18(23)15-8-14-16(25-21(15)28-19)9-22(3,4)10-17(14)26/h5-8H,9-10,23H2,1-4H3,(H,24,27)