ethyl 5-phenyl-3-[(1-thiophen-2-ylsulfonylpyrrolidin-2-yl)carbonylamino]thiophene-2-carboxylate

Systemtic Name: ethyl 5-phenyl-3-[(1-thiophen-2-ylsulfonylpyrrolidin-2-yl)carbonylamino]thiophene-2-carboxylate Openeye Name: ethyl 5-phenyl-3-[[1-(2-thienylsulfonyl)pyrrolidine-2-carbonyl]amino]thiophene-2-carboxylate CAS Name: 3-[[oxo-(1-thiophen-2-ylsulfonyl-2-pyrrolidinyl)methyl]amino]-5-phenyl-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-phenyl-3-[(1-thiophen-2-ylsulfonylpyrrolidine-2-carbonyl)amino]thiophene-2-carboxylate Traditional Name: 5-phenyl-3-[[1-(2-thienylsulfonyl)prolyl]amino]thiophene-2-carboxylic acid ethyl ester Formula: C22H22N2O5S3 MolecularWeight: 490.61548

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C=C(S1)C2=CC=CC=C2)NC(=O)C3CCCN3S(=O)(=O)C4=CC=CS4

Isomeric SMILES

CCOC(=O)C1=C(C=C(S1)C2=CC=CC=C2)NC(=O)C3CCCN3S(=O)(=O)C4=CC=CS4

InChI

InChI=1S/C22H22N2O5S3/c1-2-29-22(26)20-16(14-18(31-20)15-8-4-3-5-9-15)23-21(25)17-10-6-12-24(17)32(27,28)19-11-7-13-30-19/h3-5,7-9,11,13-14,17H,2,6,10,12H2,1H3,(H,23,25)