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

Systemtic Name: propyl 6-ethyl-2-[[3-methyl-2-(4-propylphenyl)quinolin-4-yl]carbonylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Openeye Name: propyl 6-ethyl-2-[[3-methyl-2-(4-propylphenyl)quinoline-4-carbonyl]amino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxylate CAS Name: 6-ethyl-2-[[[3-methyl-2-(4-propylphenyl)-4-quinolinyl]-oxomethyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid propyl ester IUPAC Name: propyl 6-ethyl-2-[[3-methyl-2-(4-propylphenyl)quinoline-4-carbonyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Traditional Name: 6-ethyl-2-[[3-methyl-2-(4-propylphenyl)quinoline-4-carbonyl]amino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxylic acid propyl ester Formula: C34H38N2O3S MolecularWeight: 554.74212

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2C)C(=O)NC4=C(C5=C(S4)CC(CC5)CC)C(=O)OCCC

Isomeric SMILES

CCCC1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2C)C(=O)NC4=C(C5=C(S4)CC(CC5)CC)C(=O)OCCC

InChI

InChI=1S/C34H38N2O3S/c1-5-10-23-13-16-24(17-14-23)31-21(4)29(25-11-8-9-12-27(25)35-31)32(37)36-33-30(34(38)39-19-6-2)26-18-15-22(7-3)20-28(26)40-33/h8-9,11-14,16-17,22H,5-7,10,15,18-20H2,1-4H3,(H,36,37)