ethyl 4-[2-[(4-acetamidophenyl)sulfonyl-methyl-amino]propanoyl]-1,3,5-trimethyl-pyrrole-2-carboxylate

Systemtic Name: ethyl 4-[2-[(4-acetamidophenyl)sulfonyl-methyl-amino]propanoyl]-1,3,5-trimethyl-pyrrole-2-carboxylate Openeye Name: ethyl 4-[2-[(4-acetamidophenyl)sulfonyl-methyl-amino]propanoyl]-1,3,5-trimethyl-pyrrole-2-carboxylate CAS Name: 4-[2-[(4-acetamidophenyl)sulfonyl-methylamino]-1-oxopropyl]-1,3,5-trimethyl-2-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[2-[(4-acetamidophenyl)sulfonyl-methylamino]propanoyl]-1,3,5-trimethylpyrrole-2-carboxylate Traditional Name: 4-[2-[(4-acetamidophenyl)sulfonyl-methyl-amino]propanoyl]-1,3,5-trimethyl-pyrrole-2-carboxylic acid ethyl ester Formula: C22H29N3O6S MolecularWeight: 463.54716

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(N1C)C)C(=O)C(C)N(C)S(=O)(=O)C2=CC=C(C=C2)NC(=O)C)C

Isomeric SMILES

CCOC(=O)C1=C(C(=C(N1C)C)C(=O)C(C)N(C)S(=O)(=O)C2=CC=C(C=C2)NC(=O)C)C

InChI

InChI=1S/C22H29N3O6S/c1-8-31-22(28)20-13(2)19(14(3)24(20)6)21(27)15(4)25(7)32(29,30)18-11-9-17(10-12-18)23-16(5)26/h9-12,15H,8H2,1-7H3,(H,23,26)