1-methyl-2-[2-methyl-5-nitro-3-(phenylmethyl)imidazol-4-yl]sulfanyl-benzimidazole

Systemtic Name: 1-methyl-2-[2-methyl-5-nitro-3-(phenylmethyl)imidazol-4-yl]sulfanyl-benzimidazole Openeye Name: 2-(3-benzyl-2-methyl-5-nitro-imidazol-4-yl)sulfanyl-1-methyl-benzimidazole CAS Name: 1-methyl-2-[[2-methyl-5-nitro-3-(phenylmethyl)-4-imidazolyl]thio]benzimidazole IUPAC Name: 2-(3-benzyl-2-methyl-5-nitroimidazol-4-yl)sulfanyl-1-methylbenzimidazole Traditional Name: 2-[(3-benzyl-2-methyl-5-nitro-imidazol-4-yl)thio]-1-methyl-benzimidazole Formula: C19H17N5O2S MolecularWeight: 379.43558

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(N1CC2=CC=CC=C2)SC3=NC4=CC=CC=C4N3C)[N+](=O)[O-]

Isomeric SMILES

CC1=NC(=C(N1CC2=CC=CC=C2)SC3=NC4=CC=CC=C4N3C)[N+](=O)[O-]

InChI

InChI=1S/C19H17N5O2S/c1-13-20-17(24(25)26)18(23(13)12-14-8-4-3-5-9-14)27-19-21-15-10-6-7-11-16(15)22(19)2/h3-11H,12H2,1-2H3