ethyl 2-[[5-(4-methoxyphenyl)-3-oxidanylidene-cyclohexen-1-yl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

Systemtic Name: ethyl 2-[[5-(4-methoxyphenyl)-3-oxidanylidene-cyclohexen-1-yl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Openeye Name: ethyl 2-[[5-(4-methoxyphenyl)-3-oxo-cyclohexen-1-yl]amino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxylate CAS Name: 2-[[5-(4-methoxyphenyl)-3-oxo-1-cyclohexenyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2-[[5-(4-methoxyphenyl)-3-oxocyclohexen-1-yl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Traditional Name: 2-[[3-keto-5-(4-methoxyphenyl)cyclohexen-1-yl]amino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxylic acid ethyl ester Formula: C24H27NO4S MolecularWeight: 425.54048

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC2=C1CCCC2)NC3=CC(=O)CC(C3)C4=CC=C(C=C4)OC

Isomeric SMILES

CCOC(=O)C1=C(SC2=C1CCCC2)NC3=CC(=O)CC(C3)C4=CC=C(C=C4)OC

InChI

InChI=1S/C24H27NO4S/c1-3-29-24(27)22-20-6-4-5-7-21(20)30-23(22)25-17-12-16(13-18(26)14-17)15-8-10-19(28-2)11-9-15/h8-11,14,16,25H,3-7,12-13H2,1-2H3