ethyl 4-(methoxycarbonylcarbamoyl)-3-methyl-5-[(1-thiophen-2-ylsulfonylpyrrolidin-2-yl)carbonylamino]thiophene-2-carboxylate

Systemtic Name: ethyl 4-(methoxycarbonylcarbamoyl)-3-methyl-5-[(1-thiophen-2-ylsulfonylpyrrolidin-2-yl)carbonylamino]thiophene-2-carboxylate Openeye Name: ethyl 4-(methoxycarbonylcarbamoyl)-3-methyl-5-[[1-(2-thienylsulfonyl)pyrrolidine-2-carbonyl]amino]thiophene-2-carboxylate CAS Name: 4-[(methoxycarbonylamino)-oxomethyl]-3-methyl-5-[[oxo-(1-thiophen-2-ylsulfonyl-2-pyrrolidinyl)methyl]amino]-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(methoxycarbonylcarbamoyl)-3-methyl-5-[(1-thiophen-2-ylsulfonylpyrrolidine-2-carbonyl)amino]thiophene-2-carboxylate Traditional Name: 4-(carbomethoxycarbamoyl)-3-methyl-5-[[1-(2-thienylsulfonyl)prolyl]amino]thiophene-2-carboxylic acid ethyl ester Formula: C20H23N3O8S3 MolecularWeight: 529.60692

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(S1)NC(=O)C2CCCN2S(=O)(=O)C3=CC=CS3)C(=O)NC(=O)OC)C

Isomeric SMILES

CCOC(=O)C1=C(C(=C(S1)NC(=O)C2CCCN2S(=O)(=O)C3=CC=CS3)C(=O)NC(=O)OC)C

InChI

InChI=1S/C20H23N3O8S3/c1-4-31-19(26)15-11(2)14(17(25)22-20(27)30-3)18(33-15)21-16(24)12-7-5-9-23(12)34(28,29)13-8-6-10-32-13/h6,8,10,12H,4-5,7,9H2,1-3H3,(H,21,24)(H,22,25,27)