ethyl 1-[(3-chlorophenyl)carbonylamino]-2-methyl-5-phenyl-4-(phenylsulfonyl)pyrrole-3-carboxylate

Systemtic Name: ethyl 1-[(3-chlorophenyl)carbonylamino]-2-methyl-5-phenyl-4-(phenylsulfonyl)pyrrole-3-carboxylate Openeye Name: ethyl 4-(benzenesulfonyl)-1-[(3-chlorobenzoyl)amino]-2-methyl-5-phenyl-pyrrole-3-carboxylate CAS Name: 4-(benzenesulfonyl)-1-[[(3-chlorophenyl)-oxomethyl]amino]-2-methyl-5-phenyl-3-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(benzenesulfonyl)-1-[(3-chlorobenzoyl)amino]-2-methyl-5-phenylpyrrole-3-carboxylate Traditional Name: 4-besyl-1-[(3-chlorobenzoyl)amino]-2-methyl-5-phenyl-pyrrole-3-carboxylic acid ethyl ester Formula: C27H23ClN2O5S MolecularWeight: 522.99992

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C(=C1S(=O)(=O)C2=CC=CC=C2)C3=CC=CC=C3)NC(=O)C4=CC(=CC=C4)Cl)C

Isomeric SMILES

CCOC(=O)C1=C(N(C(=C1S(=O)(=O)C2=CC=CC=C2)C3=CC=CC=C3)NC(=O)C4=CC(=CC=C4)Cl)C

InChI

InChI=1S/C27H23ClN2O5S/c1-3-35-27(32)23-18(2)30(29-26(31)20-13-10-14-21(28)17-20)24(19-11-6-4-7-12-19)25(23)36(33,34)22-15-8-5-9-16-22/h4-17H,3H2,1-2H3,(H,29,31)