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

Systemtic Name: ethyl 2-[[1-(2-ethylphenyl)-5-oxidanylidene-pyrrolidin-3-yl]carbonylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Openeye Name: ethyl 2-[[1-(2-ethylphenyl)-5-oxo-pyrrolidine-3-carbonyl]amino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxylate CAS Name: 2-[[[1-(2-ethylphenyl)-5-oxo-3-pyrrolidinyl]-oxomethyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2-[[1-(2-ethylphenyl)-5-oxopyrrolidine-3-carbonyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Traditional Name: 2-[[1-(2-ethylphenyl)-5-keto-pyrrolidine-3-carbonyl]amino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxylic acid ethyl ester Formula: C24H28N2O4S MolecularWeight: 440.55512

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1N2CC(CC2=O)C(=O)NC3=C(C4=C(S3)CCCC4)C(=O)OCC

Isomeric SMILES

CCC1=CC=CC=C1N2CC(CC2=O)C(=O)NC3=C(C4=C(S3)CCCC4)C(=O)OCC

InChI

InChI=1S/C24H28N2O4S/c1-3-15-9-5-7-11-18(15)26-14-16(13-20(26)27)22(28)25-23-21(24(29)30-4-2)17-10-6-8-12-19(17)31-23/h5,7,9,11,16H,3-4,6,8,10,12-14H2,1-2H3,(H,25,28)