N-[5-[(2-chlorophenyl)sulfamoyl]-2-morpholin-4-yl-phenyl]-3-nitro-4-pyrrolidin-1-yl-benzamide

Systemtic Name: N-[5-[(2-chlorophenyl)sulfamoyl]-2-morpholin-4-yl-phenyl]-3-nitro-4-pyrrolidin-1-yl-benzamide Openeye Name: N-[5-[(2-chlorophenyl)sulfamoyl]-2-morpholino-phenyl]-3-nitro-4-pyrrolidin-1-yl-benzamide CAS Name: N-[5-[(2-chlorophenyl)sulfamoyl]-2-(4-morpholinyl)phenyl]-3-nitro-4-(1-pyrrolidinyl)benzamide IUPAC Name: N-[5-[(2-chlorophenyl)sulfamoyl]-2-morpholin-4-ylphenyl]-3-nitro-4-pyrrolidin-1-ylbenzamide Traditional Name: N-[5-[(2-chlorophenyl)sulfamoyl]-2-morpholino-phenyl]-3-nitro-4-pyrrolidino-benzamide Formula: C27H28ClN5O6S MolecularWeight: 586.05912

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=C(C=C(C=C2)C(=O)NC3=C(C=CC(=C3)S(=O)(=O)NC4=CC=CC=C4Cl)N5CCOCC5)[N+](=O)[O-]

Isomeric SMILES

C1CCN(C1)C2=C(C=C(C=C2)C(=O)NC3=C(C=CC(=C3)S(=O)(=O)NC4=CC=CC=C4Cl)N5CCOCC5)[N+](=O)[O-]

InChI

InChI=1S/C27H28ClN5O6S/c28-21-5-1-2-6-22(21)30-40(37,38)20-8-10-24(32-13-15-39-16-14-32)23(18-20)29-27(34)19-7-9-25(26(17-19)33(35)36)31-11-3-4-12-31/h1-2,5-10,17-18,30H,3-4,11-16H2,(H,29,34)