ethyl 2-benzamido-5-[(3-chloranyl-2-methyl-phenyl)carbamoyl]-4-methyl-thiophene-3-carboxylate

Systemtic Name: ethyl 2-benzamido-5-[(3-chloranyl-2-methyl-phenyl)carbamoyl]-4-methyl-thiophene-3-carboxylate Openeye Name: ethyl 2-benzamido-5-[(3-chloro-2-methyl-phenyl)carbamoyl]-4-methyl-thiophene-3-carboxylate CAS Name: 2-benzamido-5-[(3-chloro-2-methylanilino)-oxomethyl]-4-methyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-benzamido-5-[(3-chloro-2-methylphenyl)carbamoyl]-4-methylthiophene-3-carboxylate Traditional Name: 2-benzamido-5-[(3-chloro-2-methyl-phenyl)carbamoyl]-4-methyl-thiophene-3-carboxylic acid ethyl ester Formula: C23H21ClN2O4S MolecularWeight: 456.94184

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C(=O)NC2=C(C(=CC=C2)Cl)C)NC(=O)C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C(=O)NC2=C(C(=CC=C2)Cl)C)NC(=O)C3=CC=CC=C3

InChI

InChI=1S/C23H21ClN2O4S/c1-4-30-23(29)18-14(3)19(21(28)25-17-12-8-11-16(24)13(17)2)31-22(18)26-20(27)15-9-6-5-7-10-15/h5-12H,4H2,1-3H3,(H,25,28)(H,26,27)