ethyl 2-[[4-[1-[(4-ethylphenyl)amino]-1-oxidanylidene-propan-2-yl]oxyphenyl]carbonylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

Systemtic Name: ethyl 2-[[4-[1-[(4-ethylphenyl)amino]-1-oxidanylidene-propan-2-yl]oxyphenyl]carbonylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Openeye Name: ethyl 2-[[4-[2-(4-ethylanilino)-1-methyl-2-oxo-ethoxy]benzoyl]amino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxylate CAS Name: 2-[[[4-[1-(4-ethylanilino)-1-oxopropan-2-yl]oxyphenyl]-oxomethyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2-[[4-[1-(4-ethylanilino)-1-oxopropan-2-yl]oxybenzoyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Traditional Name: 2-[[4-[2-(4-ethylanilino)-2-keto-1-methyl-ethoxy]benzoyl]amino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxylic acid ethyl ester Formula: C29H32N2O5S MolecularWeight: 520.63978

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)NC(=O)C(C)OC2=CC=C(C=C2)C(=O)NC3=C(C4=C(S3)CCCC4)C(=O)OCC

Isomeric SMILES

CCC1=CC=C(C=C1)NC(=O)C(C)OC2=CC=C(C=C2)C(=O)NC3=C(C4=C(S3)CCCC4)C(=O)OCC

InChI

InChI=1S/C29H32N2O5S/c1-4-19-10-14-21(15-11-19)30-26(32)18(3)36-22-16-12-20(13-17-22)27(33)31-28-25(29(34)35-5-2)23-8-6-7-9-24(23)37-28/h10-18H,4-9H2,1-3H3,(H,30,32)(H,31,33)