ethyl 4-acetamido-2,3-dimethyl-6-[(2-methylphenyl)methyl]thieno[2,3-b]pyrrole-5-carboxylate

Systemtic Name: ethyl 4-acetamido-2,3-dimethyl-6-[(2-methylphenyl)methyl]thieno[2,3-b]pyrrole-5-carboxylate Openeye Name: ethyl 4-acetamido-2,3-dimethyl-6-(o-tolylmethyl)thieno[2,3-b]pyrrole-5-carboxylate CAS Name: 4-acetamido-2,3-dimethyl-6-[(2-methylphenyl)methyl]-5-thieno[2,3-b]pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl 4-acetamido-2,3-dimethyl-6-[(2-methylphenyl)methyl]thieno[2,3-b]pyrrole-5-carboxylate Traditional Name: 4-acetamido-2,3-dimethyl-6-(2-methylbenzyl)thieno[2,3-b]pyrrole-5-carboxylic acid ethyl ester Formula: C21H24N2O3S MolecularWeight: 384.49186

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(N1CC3=CC=CC=C3C)SC(=C2C)C)NC(=O)C

Isomeric SMILES

CCOC(=O)C1=C(C2=C(N1CC3=CC=CC=C3C)SC(=C2C)C)NC(=O)C

InChI

InChI=1S/C21H24N2O3S/c1-6-26-21(25)19-18(22-15(5)24)17-13(3)14(4)27-20(17)23(19)11-16-10-8-7-9-12(16)2/h7-10H,6,11H2,1-5H3,(H,22,24)