3-azanyl-4-(4-dimethylaminophenyl)-7,7-dimethyl-5-oxidanylidene-6,8-dihydrothieno[2,3-b]quinoline-2-carboxylic acid

Systemtic Name: 3-azanyl-4-(4-dimethylaminophenyl)-7,7-dimethyl-5-oxidanylidene-6,8-dihydrothieno[2,3-b]quinoline-2-carboxylic acid Openeye Name: 3-amino-4-(4-dimethylaminophenyl)-7,7-dimethyl-5-oxo-6,8-dihydrothieno[2,3-b]quinoline-2-carboxylic acid CAS Name: 3-amino-4-(4-dimethylaminophenyl)-7,7-dimethyl-5-oxo-6,8-dihydrothieno[2,3-b]quinoline-2-carboxylic acid IUPAC Name: 3-amino-4-(4-dimethylaminophenyl)-7,7-dimethyl-5-oxo-6,8-dihydrothieno[2,3-b]quinoline-2-carboxylic acid Traditional Name: 3-amino-4-(4-dimethylaminophenyl)-5-keto-7,7-dimethyl-6,8-dihydrothieno[2,3-b]quinoline-2-carboxylic acid Formula: C22H23N3O3S MolecularWeight: 409.50132

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=C(C(=O)C1)C(=C3C(=C(SC3=N2)C(=O)O)N)C4=CC=C(C=C4)N(C)C)C

Isomeric SMILES

CC1(CC2=C(C(=O)C1)C(=C3C(=C(SC3=N2)C(=O)O)N)C4=CC=C(C=C4)N(C)C)C

InChI

InChI=1S/C22H23N3O3S/c1-22(2)9-13-16(14(26)10-22)15(11-5-7-12(8-6-11)25(3)4)17-18(23)19(21(27)28)29-20(17)24-13/h5-8H,9-10,23H2,1-4H3,(H,27,28)