ethyl 2-[[4-(1,3-dithiolan-2-yl)phenyl]carbonylamino]-4-methyl-5-(methylcarbamoyl)thiophene-3-carboxylate

Systemtic Name: ethyl 2-[[4-(1,3-dithiolan-2-yl)phenyl]carbonylamino]-4-methyl-5-(methylcarbamoyl)thiophene-3-carboxylate Openeye Name: ethyl 2-[[4-(1,3-dithiolan-2-yl)benzoyl]amino]-4-methyl-5-(methylcarbamoyl)thiophene-3-carboxylate CAS Name: 2-[[[4-(1,3-dithiolan-2-yl)phenyl]-oxomethyl]amino]-4-methyl-5-(methylcarbamoyl)-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[4-(1,3-dithiolan-2-yl)benzoyl]amino]-4-methyl-5-(methylcarbamoyl)thiophene-3-carboxylate Traditional Name: 2-[[4-(1,3-dithiolan-2-yl)benzoyl]amino]-4-methyl-5-(methylcarbamoyl)thiophene-3-carboxylic acid ethyl ester Formula: C20H22N2O4S3 MolecularWeight: 450.59468

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C(=O)NC)NC(=O)C2=CC=C(C=C2)C3SCCS3

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C(=O)NC)NC(=O)C2=CC=C(C=C2)C3SCCS3

InChI

InChI=1S/C20H22N2O4S3/c1-4-26-19(25)14-11(2)15(17(24)21-3)29-18(14)22-16(23)12-5-7-13(8-6-12)20-27-9-10-28-20/h5-8,20H,4,9-10H2,1-3H3,(H,21,24)(H,22,23)