ethyl 2,4-dimethyl-5-[[2-(morpholin-4-ylsulfonylmethyl)phenyl]methylcarbamoyl]-1H-pyrrole-3-carboxylate

Systemtic Name: ethyl 2,4-dimethyl-5-[[2-(morpholin-4-ylsulfonylmethyl)phenyl]methylcarbamoyl]-1H-pyrrole-3-carboxylate Openeye Name: ethyl 2,4-dimethyl-5-[[2-(morpholinosulfonylmethyl)phenyl]methylcarbamoyl]-1H-pyrrole-3-carboxylate CAS Name: 2,4-dimethyl-5-[[[2-(4-morpholinylsulfonylmethyl)phenyl]methylamino]-oxomethyl]-1H-pyrrole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2,4-dimethyl-5-[[2-(morpholin-4-ylsulfonylmethyl)phenyl]methylcarbamoyl]-1H-pyrrole-3-carboxylate Traditional Name: 2,4-dimethyl-5-[[2-(morpholinosulfonylmethyl)benzyl]carbamoyl]-1H-pyrrole-3-carboxylic acid ethyl ester Formula: C22H29N3O6S MolecularWeight: 463.54716

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=C1C)C(=O)NCC2=CC=CC=C2CS(=O)(=O)N3CCOCC3)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=C1C)C(=O)NCC2=CC=CC=C2CS(=O)(=O)N3CCOCC3)C

InChI

InChI=1S/C22H29N3O6S/c1-4-31-22(27)19-15(2)20(24-16(19)3)21(26)23-13-17-7-5-6-8-18(17)14-32(28,29)25-9-11-30-12-10-25/h5-8,24H,4,9-14H2,1-3H3,(H,23,26)