1-cyclopropyl-8-methoxy-4-oxidanylidene-7-[4-(1,3-thiazol-2-ylcarbonylamino)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]quinoline-3-carboxylic acid

Systemtic Name: 1-cyclopropyl-8-methoxy-4-oxidanylidene-7-[4-(1,3-thiazol-2-ylcarbonylamino)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]quinoline-3-carboxylic acid Openeye Name: 1-cyclopropyl-8-methoxy-4-oxo-7-[4-(thiazole-2-carbonylamino)-4,5,6,7-tetrahydrobenzothiophen-2-yl]quinoline-3-carboxylic acid CAS Name: 1-cyclopropyl-8-methoxy-4-oxo-7-[4-[[oxo(2-thiazolyl)methyl]amino]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-3-quinolinecarboxylic acid IUPAC Name: 1-cyclopropyl-8-methoxy-4-oxo-7-[4-(1,3-thiazole-2-carbonylamino)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]quinoline-3-carboxylic acid Traditional Name: 1-cyclopropyl-4-keto-8-methoxy-7-[4-(thiazole-2-carbonylamino)-4,5,6,7-tetrahydrobenzothiophen-2-yl]quinoline-3-carboxylic acid Formula: C26H23N3O5S2 MolecularWeight: 521.60792

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC2=C1N(C=C(C2=O)C(=O)O)C3CC3)C4=CC5=C(S4)CCCC5NC(=O)C6=NC=CS6

Isomeric SMILES

COC1=C(C=CC2=C1N(C=C(C2=O)C(=O)O)C3CC3)C4=CC5=C(S4)CCCC5NC(=O)C6=NC=CS6

InChI

InChI=1S/C26H23N3O5S2/c1-34-23-14(7-8-15-21(23)29(13-5-6-13)12-17(22(15)30)26(32)33)20-11-16-18(3-2-4-19(16)36-20)28-24(31)25-27-9-10-35-25/h7-13,18H,2-6H2,1H3,(H,28,31)(H,32,33)