1-methyl-4-morpholin-4-ylsulfonyl-N-(1-phenylbutan-2-yl)pyrrole-2-carboxamide

Systemtic Name: 1-methyl-4-morpholin-4-ylsulfonyl-N-(1-phenylbutan-2-yl)pyrrole-2-carboxamide Openeye Name: N-(1-benzylpropyl)-1-methyl-4-morpholinosulfonyl-pyrrole-2-carboxamide CAS Name: 1-methyl-4-(4-morpholinylsulfonyl)-N-(1-phenylbutan-2-yl)-2-pyrrolecarboxamide IUPAC Name: 1-methyl-4-morpholin-4-ylsulfonyl-N-(1-phenylbutan-2-yl)pyrrole-2-carboxamide Traditional Name: N-(1-benzylpropyl)-1-methyl-4-morpholinosulfonyl-pyrrole-2-carboxamide Formula: C20H27N3O4S MolecularWeight: 405.51108

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC1=CC=CC=C1)NC(=O)C2=CC(=CN2C)S(=O)(=O)N3CCOCC3

Isomeric SMILES

CCC(CC1=CC=CC=C1)NC(=O)C2=CC(=CN2C)S(=O)(=O)N3CCOCC3

InChI

InChI=1S/C20H27N3O4S/c1-3-17(13-16-7-5-4-6-8-16)21-20(24)19-14-18(15-22(19)2)28(25,26)23-9-11-27-12-10-23/h4-8,14-15,17H,3,9-13H2,1-2H3,(H,21,24)