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

Systemtic Name: N-cyclopropyl-2-[2-methylpropyl-(4-nitrophenyl)sulfonyl-amino]-N-[(1-methylpyrrol-2-yl)methyl]ethanamide Openeye Name: N-cyclopropyl-2-[isobutyl-(4-nitrophenyl)sulfonyl-amino]-N-[(1-methylpyrrol-2-yl)methyl]acetamide CAS Name: N-cyclopropyl-2-[2-methylpropyl-(4-nitrophenyl)sulfonylamino]-N-[(1-methyl-2-pyrrolyl)methyl]acetamide IUPAC Name: N-cyclopropyl-2-[2-methylpropyl-(4-nitrophenyl)sulfonylamino]-N-[(1-methylpyrrol-2-yl)methyl]acetamide Traditional Name: N-cyclopropyl-2-[isobutyl(nosyl)amino]-N-[(1-methylpyrrol-2-yl)methyl]acetamide Formula: C21H28N4O5S MolecularWeight: 448.53582

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN(CC(=O)N(CC1=CC=CN1C)C2CC2)S(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC(C)CN(CC(=O)N(CC1=CC=CN1C)C2CC2)S(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C21H28N4O5S/c1-16(2)13-23(31(29,30)20-10-8-18(9-11-20)25(27)28)15-21(26)24(17-6-7-17)14-19-5-4-12-22(19)3/h4-5,8-12,16-17H,6-7,13-15H2,1-3H3