N-[[5-(3-nitrophenyl)sulfanyl-4-propan-2-yl-1-(pyridin-2-ylmethyl)imidazol-2-yl]methyl]methanesulfonamide

Systemtic Name: N-[[5-(3-nitrophenyl)sulfanyl-4-propan-2-yl-1-(pyridin-2-ylmethyl)imidazol-2-yl]methyl]methanesulfonamide Openeye Name: N-[[4-isopropyl-5-(3-nitrophenyl)sulfanyl-1-(2-pyridylmethyl)imidazol-2-yl]methyl]methanesulfonamide CAS Name: N-[[5-[(3-nitrophenyl)thio]-4-propan-2-yl-1-(2-pyridinylmethyl)-2-imidazolyl]methyl]methanesulfonamide IUPAC Name: N-[[5-(3-nitrophenyl)sulfanyl-4-propan-2-yl-1-(pyridin-2-ylmethyl)imidazol-2-yl]methyl]methanesulfonamide Traditional Name: N-[[4-isopropyl-5-[(3-nitrophenyl)thio]-1-(2-pyridylmethyl)imidazol-2-yl]methyl]methanesulfonamide Formula: C20H23N5O4S2 MolecularWeight: 461.55772

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(N(C(=N1)CNS(=O)(=O)C)CC2=CC=CC=N2)SC3=CC=CC(=C3)[N+](=O)[O-]

Isomeric SMILES

CC(C)C1=C(N(C(=N1)CNS(=O)(=O)C)CC2=CC=CC=N2)SC3=CC=CC(=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H23N5O4S2/c1-14(2)19-20(30-17-9-6-8-16(11-17)25(26)27)24(13-15-7-4-5-10-21-15)18(23-19)12-22-31(3,28)29/h4-11,14,22H,12-13H2,1-3H3