(2S)-3-methyl-N-(4-morpholin-4-ylphenyl)-2-[(4-morpholin-4-ylsulfonyl-2-nitro-phenyl)amino]butanamide

Systemtic Name: (2S)-3-methyl-N-(4-morpholin-4-ylphenyl)-2-[(4-morpholin-4-ylsulfonyl-2-nitro-phenyl)amino]butanamide Openeye Name: (2S)-3-methyl-N-(4-morpholinophenyl)-2-(4-morpholinosulfonyl-2-nitro-anilino)butanamide CAS Name: (2S)-3-methyl-N-[4-(4-morpholinyl)phenyl]-2-[4-(4-morpholinylsulfonyl)-2-nitroanilino]butanamide IUPAC Name: (2S)-3-methyl-N-(4-morpholin-4-ylphenyl)-2-(4-morpholin-4-ylsulfonyl-2-nitroanilino)butanamide Traditional Name: (2S)-3-methyl-N-(4-morpholinophenyl)-2-(4-morpholinosulfonyl-2-nitro-anilino)butyramide Formula: C25H33N5O7S MolecularWeight: 547.62382

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NC1=CC=C(C=C1)N2CCOCC2)NC3=C(C=C(C=C3)S(=O)(=O)N4CCOCC4)[N+](=O)[O-]

Isomeric SMILES

CC(C)[C@@H](C(=O)NC1=CC=C(C=C1)N2CCOCC2)NC3=C(C=C(C=C3)S(=O)(=O)N4CCOCC4)[N+](=O)[O-]

InChI

InChI=1S/C25H33N5O7S/c1-18(2)24(25(31)26-19-3-5-20(6-4-19)28-9-13-36-14-10-28)27-22-8-7-21(17-23(22)30(32)33)38(34,35)29-11-15-37-16-12-29/h3-8,17-18,24,27H,9-16H2,1-2H3,(H,26,31)/t24-/m0/s1