3-(1-methyl-5-morpholin-4-ylsulfonyl-benzimidazol-2-yl)-N-(4-methyl-3-nitro-phenyl)propanamide

Systemtic Name: 3-(1-methyl-5-morpholin-4-ylsulfonyl-benzimidazol-2-yl)-N-(4-methyl-3-nitro-phenyl)propanamide Openeye Name: 3-(1-methyl-5-morpholinosulfonyl-benzimidazol-2-yl)-N-(4-methyl-3-nitro-phenyl)propanamide CAS Name: 3-[1-methyl-5-(4-morpholinylsulfonyl)-2-benzimidazolyl]-N-(4-methyl-3-nitrophenyl)propanamide IUPAC Name: 3-(1-methyl-5-morpholin-4-ylsulfonylbenzimidazol-2-yl)-N-(4-methyl-3-nitrophenyl)propanamide Traditional Name: 3-(1-methyl-5-morpholinosulfonyl-benzimidazol-2-yl)-N-(4-methyl-3-nitro-phenyl)propionamide Formula: C22H25N5O6S MolecularWeight: 487.5288

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)CCC2=NC3=C(N2C)C=CC(=C3)S(=O)(=O)N4CCOCC4)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)CCC2=NC3=C(N2C)C=CC(=C3)S(=O)(=O)N4CCOCC4)[N+](=O)[O-]

InChI

InChI=1S/C22H25N5O6S/c1-15-3-4-16(13-20(15)27(29)30)23-22(28)8-7-21-24-18-14-17(5-6-19(18)25(21)2)34(31,32)26-9-11-33-12-10-26/h3-6,13-14H,7-12H2,1-2H3,(H,23,28)