methyl 4-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[2-(4-methyl-2-oxidanylidene-quinolin-1-yl)butanoylamino]thiophene-3-carboxylate

Systemtic Name: methyl 4-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[2-(4-methyl-2-oxidanylidene-quinolin-1-yl)butanoylamino]thiophene-3-carboxylate Openeye Name: methyl 4-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[2-(4-methyl-2-oxo-1-quinolyl)butanoylamino]thiophene-3-carboxylate CAS Name: 4-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[[2-(4-methyl-2-oxo-1-quinolinyl)-1-oxobutyl]amino]-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 4-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[2-(4-methyl-2-oxoquinolin-1-yl)butanoylamino]thiophene-3-carboxylate Traditional Name: 4-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[2-(2-keto-4-methyl-1-quinolyl)butanoylamino]thiophene-3-carboxylic acid methyl ester Formula: C28H26N2O6S MolecularWeight: 518.58084

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=C(C(=CS1)C2=CC3=C(C=C2)OCCO3)C(=O)OC)N4C5=CC=CC=C5C(=CC4=O)C

Isomeric SMILES

CCC(C(=O)NC1=C(C(=CS1)C2=CC3=C(C=C2)OCCO3)C(=O)OC)N4C5=CC=CC=C5C(=CC4=O)C

InChI

InChI=1S/C28H26N2O6S/c1-4-20(30-21-8-6-5-7-18(21)16(2)13-24(30)31)26(32)29-27-25(28(33)34-3)19(15-37-27)17-9-10-22-23(14-17)36-12-11-35-22/h5-10,13-15,20H,4,11-12H2,1-3H3,(H,29,32)