N-(2-methylpropyl)-N-[(1-methylpyrrol-2-yl)methyl]-2-[(4-nitrophenyl)sulfonyl-propyl-amino]ethanamide

Systemtic Name: N-(2-methylpropyl)-N-[(1-methylpyrrol-2-yl)methyl]-2-[(4-nitrophenyl)sulfonyl-propyl-amino]ethanamide Openeye Name: N-isobutyl-N-[(1-methylpyrrol-2-yl)methyl]-2-[(4-nitrophenyl)sulfonyl-propyl-amino]acetamide CAS Name: N-(2-methylpropyl)-N-[(1-methyl-2-pyrrolyl)methyl]-2-[(4-nitrophenyl)sulfonyl-propylamino]acetamide IUPAC Name: N-(2-methylpropyl)-N-[(1-methylpyrrol-2-yl)methyl]-2-[(4-nitrophenyl)sulfonyl-propylamino]acetamide Traditional Name: N-isobutyl-N-[(1-methylpyrrol-2-yl)methyl]-2-[nosyl(propyl)amino]acetamide Formula: C21H30N4O5S MolecularWeight: 450.5517

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CC(=O)N(CC1=CC=CN1C)CC(C)C)S(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CCCN(CC(=O)N(CC1=CC=CN1C)CC(C)C)S(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C21H30N4O5S/c1-5-12-24(31(29,30)20-10-8-18(9-11-20)25(27)28)16-21(26)23(14-17(2)3)15-19-7-6-13-22(19)4/h6-11,13,17H,5,12,14-16H2,1-4H3