1-[2,5-dimethyl-1-(5-morpholin-4-ylsulfonyl-2-pyrrolidin-1-yl-phenyl)pyrrol-3-yl]-N-(4-nitrophenyl)methanimine

Systemtic Name: 1-[2,5-dimethyl-1-(5-morpholin-4-ylsulfonyl-2-pyrrolidin-1-yl-phenyl)pyrrol-3-yl]-N-(4-nitrophenyl)methanimine Openeye Name: 1-[2,5-dimethyl-1-(5-morpholinosulfonyl-2-pyrrolidin-1-yl-phenyl)pyrrol-3-yl]-N-(4-nitrophenyl)methanimine CAS Name: 1-[2,5-dimethyl-1-[5-(4-morpholinylsulfonyl)-2-(1-pyrrolidinyl)phenyl]-3-pyrrolyl]-N-(4-nitrophenyl)methanimine IUPAC Name: 1-[2,5-dimethyl-1-(5-morpholin-4-ylsulfonyl-2-pyrrolidin-1-ylphenyl)pyrrol-3-yl]-N-(4-nitrophenyl)methanimine Traditional Name: [2,5-dimethyl-1-(5-morpholinosulfonyl-2-pyrrolidino-phenyl)pyrrol-3-yl]methylene-(4-nitrophenyl)amine Formula: C27H31N5O5S MolecularWeight: 537.63054

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=C(C=CC(=C2)S(=O)(=O)N3CCOCC3)N4CCCC4)C)C=NC5=CC=C(C=C5)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(N1C2=C(C=CC(=C2)S(=O)(=O)N3CCOCC3)N4CCCC4)C)C=NC5=CC=C(C=C5)[N+](=O)[O-]

InChI

InChI=1S/C27H31N5O5S/c1-20-17-22(19-28-23-5-7-24(8-6-23)32(33)34)21(2)31(20)27-18-25(9-10-26(27)29-11-3-4-12-29)38(35,36)30-13-15-37-16-14-30/h5-10,17-19H,3-4,11-16H2,1-2H3