ethyl 6-ethyl-2-[[6-ethyl-2-(5-methylfuran-2-yl)quinolin-4-yl]carbonylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

Systemtic Name: ethyl 6-ethyl-2-[[6-ethyl-2-(5-methylfuran-2-yl)quinolin-4-yl]carbonylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Openeye Name: ethyl 6-ethyl-2-[[6-ethyl-2-(5-methyl-2-furyl)quinoline-4-carbonyl]amino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxylate CAS Name: 6-ethyl-2-[[[6-ethyl-2-(5-methyl-2-furanyl)-4-quinolinyl]-oxomethyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid ethyl ester IUPAC Name: ethyl 6-ethyl-2-[[6-ethyl-2-(5-methylfuran-2-yl)quinoline-4-carbonyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Traditional Name: 6-ethyl-2-[[6-ethyl-2-(5-methyl-2-furyl)quinoline-4-carbonyl]amino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxylic acid ethyl ester Formula: C30H32N2O4S MolecularWeight: 516.65108

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCC2=C(C1)SC(=C2C(=O)OCC)NC(=O)C3=CC(=NC4=C3C=C(C=C4)CC)C5=CC=C(O5)C

Isomeric SMILES

CCC1CCC2=C(C1)SC(=C2C(=O)OCC)NC(=O)C3=CC(=NC4=C3C=C(C=C4)CC)C5=CC=C(O5)C

InChI

InChI=1S/C30H32N2O4S/c1-5-18-10-12-23-21(14-18)22(16-24(31-23)25-13-8-17(4)36-25)28(33)32-29-27(30(34)35-7-3)20-11-9-19(6-2)15-26(20)37-29/h8,10,12-14,16,19H,5-7,9,11,15H2,1-4H3,(H,32,33)