1-cyclopropyl-7-(6-methyl-4,5,6,7-tetrahydrothieno[3,2-c]pyridin-2-yl)-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 1-cyclopropyl-7-(6-methyl-4,5,6,7-tetrahydrothieno[3,2-c]pyridin-2-yl)-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 1-cyclopropyl-7-(6-methyl-4,5,6,7-tetrahydrothieno[3,2-c]pyridin-2-yl)-4-oxo-quinoline-3-carboxylic acid CAS Name: 1-cyclopropyl-7-(6-methyl-4,5,6,7-tetrahydrothieno[3,2-c]pyridin-2-yl)-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 1-cyclopropyl-7-(6-methyl-4,5,6,7-tetrahydrothieno[3,2-c]pyridin-2-yl)-4-oxoquinoline-3-carboxylic acid Traditional Name: 1-cyclopropyl-4-keto-7-(6-methyl-4,5,6,7-tetrahydrothieno[3,2-c]pyridin-2-yl)quinoline-3-carboxylic acid Formula: C21H20N2O3S MolecularWeight: 380.4601

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC2=C(CN1)C=C(S2)C3=CC4=C(C=C3)C(=O)C(=CN4C5CC5)C(=O)O

Isomeric SMILES

CC1CC2=C(CN1)C=C(S2)C3=CC4=C(C=C3)C(=O)C(=CN4C5CC5)C(=O)O

InChI

InChI=1S/C21H20N2O3S/c1-11-6-18-13(9-22-11)8-19(27-18)12-2-5-15-17(7-12)23(14-3-4-14)10-16(20(15)24)21(25)26/h2,5,7-8,10-11,14,22H,3-4,6,9H2,1H3,(H,25,26)