methyl 3-[[2-(1,3-benzodioxol-5-yl)-6-methyl-quinolin-4-yl]carbonylamino]thiophene-2-carboxylate

Systemtic Name: methyl 3-[[2-(1,3-benzodioxol-5-yl)-6-methyl-quinolin-4-yl]carbonylamino]thiophene-2-carboxylate Openeye Name: methyl 3-[[2-(1,3-benzodioxol-5-yl)-6-methyl-quinoline-4-carbonyl]amino]thiophene-2-carboxylate CAS Name: 3-[[[2-(1,3-benzodioxol-5-yl)-6-methyl-4-quinolinyl]-oxomethyl]amino]-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 3-[[2-(1,3-benzodioxol-5-yl)-6-methylquinoline-4-carbonyl]amino]thiophene-2-carboxylate Traditional Name: 3-[[2-(1,3-benzodioxol-5-yl)-6-methyl-quinoline-4-carbonyl]amino]thiophene-2-carboxylic acid methyl ester Formula: C24H18N2O5S MolecularWeight: 446.47512

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(C=C2C(=O)NC3=C(SC=C3)C(=O)OC)C4=CC5=C(C=C4)OCO5

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(C=C2C(=O)NC3=C(SC=C3)C(=O)OC)C4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C24H18N2O5S/c1-13-3-5-17-15(9-13)16(23(27)26-18-7-8-32-22(18)24(28)29-2)11-19(25-17)14-4-6-20-21(10-14)31-12-30-20/h3-11H,12H2,1-2H3,(H,26,27)