5-[1-[[4-(4-methylpiperidin-1-yl)sulfonyl-2-nitro-phenyl]amino]ethyl]-1,3-dihydrobenzimidazol-2-one

Systemtic Name: 5-[1-[[4-(4-methylpiperidin-1-yl)sulfonyl-2-nitro-phenyl]amino]ethyl]-1,3-dihydrobenzimidazol-2-one Openeye Name: 5-[1-[4-[(4-methyl-1-piperidyl)sulfonyl]-2-nitro-anilino]ethyl]-1,3-dihydrobenzimidazol-2-one CAS Name: 5-[1-[4-[(4-methyl-1-piperidinyl)sulfonyl]-2-nitroanilino]ethyl]-1,3-dihydrobenzimidazol-2-one IUPAC Name: 5-[1-[4-(4-methylpiperidin-1-yl)sulfonyl-2-nitroanilino]ethyl]-1,3-dihydrobenzimidazol-2-one Traditional Name: 5-[1-[4-(4-methylpiperidino)sulfonyl-2-nitro-anilino]ethyl]-1,3-dihydrobenzimidazol-2-one Formula: C21H25N5O5S MolecularWeight: 459.5187

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)NC(C)C3=CC4=C(C=C3)NC(=O)N4)[N+](=O)[O-]

Isomeric SMILES

CC1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)NC(C)C3=CC4=C(C=C3)NC(=O)N4)[N+](=O)[O-]

InChI

InChI=1S/C21H25N5O5S/c1-13-7-9-25(10-8-13)32(30,31)16-4-6-18(20(12-16)26(28)29)22-14(2)15-3-5-17-19(11-15)24-21(27)23-17/h3-6,11-14,22H,7-10H2,1-2H3,(H2,23,24,27)