6-chloranyl-2-[2-methyl-5-nitro-3-(phenylmethyl)imidazol-4-yl]sulfanyl-1H-imidazo[4,5-b]pyridine

Systemtic Name: 6-chloranyl-2-[2-methyl-5-nitro-3-(phenylmethyl)imidazol-4-yl]sulfanyl-1H-imidazo[4,5-b]pyridine Openeye Name: 2-(3-benzyl-2-methyl-5-nitro-imidazol-4-yl)sulfanyl-6-chloro-1H-imidazo[4,5-b]pyridine CAS Name: 6-chloro-2-[[2-methyl-5-nitro-3-(phenylmethyl)-4-imidazolyl]thio]-1H-imidazo[4,5-b]pyridine IUPAC Name: 2-(3-benzyl-2-methyl-5-nitroimidazol-4-yl)sulfanyl-6-chloro-1H-imidazo[4,5-b]pyridine Traditional Name: 2-[(3-benzyl-2-methyl-5-nitro-imidazol-4-yl)thio]-6-chloro-1H-imidazo[4,5-b]pyridine Formula: C17H13ClN6O2S MolecularWeight: 400.84212

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(N1CC2=CC=CC=C2)SC3=NC4=NC=C(C=C4N3)Cl)[N+](=O)[O-]

Isomeric SMILES

CC1=NC(=C(N1CC2=CC=CC=C2)SC3=NC4=NC=C(C=C4N3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C17H13ClN6O2S/c1-10-20-15(24(25)26)16(23(10)9-11-5-3-2-4-6-11)27-17-21-13-7-12(18)8-19-14(13)22-17/h2-8H,9H2,1H3,(H,19,21,22)