4-ethanoyl-N-(4-methyl-3-morpholin-4-ylsulfonyl-phenyl)-1H-pyrrole-2-carboxamide

Systemtic Name: 4-ethanoyl-N-(4-methyl-3-morpholin-4-ylsulfonyl-phenyl)-1H-pyrrole-2-carboxamide Openeye Name: 4-acetyl-N-(4-methyl-3-morpholinosulfonyl-phenyl)-1H-pyrrole-2-carboxamide CAS Name: 4-acetyl-N-[4-methyl-3-(4-morpholinylsulfonyl)phenyl]-1H-pyrrole-2-carboxamide IUPAC Name: 4-acetyl-N-(4-methyl-3-morpholin-4-ylsulfonylphenyl)-1H-pyrrole-2-carboxamide Traditional Name: 4-acetyl-N-(4-methyl-3-morpholinosulfonyl-phenyl)-1H-pyrrole-2-carboxamide Formula: C18H21N3O5S MolecularWeight: 391.44144

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C2=CC(=CN2)C(=O)C)S(=O)(=O)N3CCOCC3

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C2=CC(=CN2)C(=O)C)S(=O)(=O)N3CCOCC3

InChI

InChI=1S/C18H21N3O5S/c1-12-3-4-15(20-18(23)16-9-14(11-19-16)13(2)22)10-17(12)27(24,25)21-5-7-26-8-6-21/h3-4,9-11,19H,5-8H2,1-2H3,(H,20,23)