N-[(2-fluorophenyl)-(1-methylimidazol-2-yl)methyl]-4-(3-methylpiperidin-1-yl)sulfonyl-2-nitro-aniline

Systemtic Name: N-[(2-fluorophenyl)-(1-methylimidazol-2-yl)methyl]-4-(3-methylpiperidin-1-yl)sulfonyl-2-nitro-aniline Openeye Name: N-[(2-fluorophenyl)-(1-methylimidazol-2-yl)methyl]-4-[(3-methyl-1-piperidyl)sulfonyl]-2-nitro-aniline CAS Name: N-[(2-fluorophenyl)-(1-methyl-2-imidazolyl)methyl]-4-[(3-methyl-1-piperidinyl)sulfonyl]-2-nitroaniline IUPAC Name: N-[(2-fluorophenyl)-(1-methylimidazol-2-yl)methyl]-4-(3-methylpiperidin-1-yl)sulfonyl-2-nitroaniline Traditional Name: [(2-fluorophenyl)-(1-methylimidazol-2-yl)methyl]-[4-(3-methylpiperidino)sulfonyl-2-nitro-phenyl]amine Formula: C23H26FN5O4S MolecularWeight: 487.547043

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)S(=O)(=O)C2=CC(=C(C=C2)NC(C3=CC=CC=C3F)C4=NC=CN4C)[N+](=O)[O-]

Isomeric SMILES

CC1CCCN(C1)S(=O)(=O)C2=CC(=C(C=C2)NC(C3=CC=CC=C3F)C4=NC=CN4C)[N+](=O)[O-]

InChI

InChI=1S/C23H26FN5O4S/c1-16-6-5-12-28(15-16)34(32,33)17-9-10-20(21(14-17)29(30)31)26-22(23-25-11-13-27(23)2)18-7-3-4-8-19(18)24/h3-4,7-11,13-14,16,22,26H,5-6,12,15H2,1-2H3