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

Systemtic Name: methyl 1-cyclopropyl-8-methoxy-4-oxidanylidene-7-[4-(1,3-thiazol-2-ylcarbonylamino)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]quinoline-3-carboxylate Openeye Name: methyl 1-cyclopropyl-8-methoxy-4-oxo-7-[4-(thiazole-2-carbonylamino)-4,5,6,7-tetrahydrobenzothiophen-2-yl]quinoline-3-carboxylate 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 methyl ester IUPAC Name: methyl 1-cyclopropyl-8-methoxy-4-oxo-7-[4-(1,3-thiazole-2-carbonylamino)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]quinoline-3-carboxylate Traditional Name: 1-cyclopropyl-4-keto-8-methoxy-7-[4-(thiazole-2-carbonylamino)-4,5,6,7-tetrahydrobenzothiophen-2-yl]quinoline-3-carboxylic acid methyl ester Formula: C27H25N3O5S2 MolecularWeight: 535.6345

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H25N3O5S2/c1-34-24-15(8-9-16-22(24)30(14-6-7-14)13-18(23(16)31)27(33)35-2)21-12-17-19(4-3-5-20(17)37-21)29-25(32)26-28-10-11-36-26/h8-14,19H,3-7H2,1-2H3,(H,29,32)