ethyl 2-[2-[4-[(3-chloranyl-4-methoxy-phenyl)carbamoyl]phenoxy]ethanoylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

Systemtic Name: ethyl 2-[2-[4-[(3-chloranyl-4-methoxy-phenyl)carbamoyl]phenoxy]ethanoylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Openeye Name: ethyl 2-[[2-[4-[(3-chloro-4-methoxy-phenyl)carbamoyl]phenoxy]acetyl]amino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxylate CAS Name: 2-[[2-[4-[(3-chloro-4-methoxyanilino)-oxomethyl]phenoxy]-1-oxoethyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2-[[2-[4-[(3-chloro-4-methoxyphenyl)carbamoyl]phenoxy]acetyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Traditional Name: 2-[[2-[4-[(3-chloro-4-methoxy-phenyl)carbamoyl]phenoxy]acetyl]amino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxylic acid ethyl ester Formula: C27H27ClN2O6S MolecularWeight: 543.03108

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC2=C1CCCC2)NC(=O)COC3=CC=C(C=C3)C(=O)NC4=CC(=C(C=C4)OC)Cl

Isomeric SMILES

CCOC(=O)C1=C(SC2=C1CCCC2)NC(=O)COC3=CC=C(C=C3)C(=O)NC4=CC(=C(C=C4)OC)Cl

InChI

InChI=1S/C27H27ClN2O6S/c1-3-35-27(33)24-19-6-4-5-7-22(19)37-26(24)30-23(31)15-36-18-11-8-16(9-12-18)25(32)29-17-10-13-21(34-2)20(28)14-17/h8-14H,3-7,15H2,1-2H3,(H,29,32)(H,30,31)