4-[(6-chloranyl-1H-imidazo[4,5-b]pyridin-2-yl)sulfanylmethyl]-3-nitro-benzamide

Systemtic Name: 4-[(6-chloranyl-1H-imidazo[4,5-b]pyridin-2-yl)sulfanylmethyl]-3-nitro-benzamide Openeye Name: 4-[(6-chloro-1H-imidazo[4,5-b]pyridin-2-yl)sulfanylmethyl]-3-nitro-benzamide CAS Name: 4-[[(6-chloro-1H-imidazo[4,5-b]pyridin-2-yl)thio]methyl]-3-nitrobenzamide IUPAC Name: 4-[(6-chloro-1H-imidazo[4,5-b]pyridin-2-yl)sulfanylmethyl]-3-nitrobenzamide Traditional Name: 4-[[(6-chloro-1H-imidazo[4,5-b]pyridin-2-yl)thio]methyl]-3-nitro-benzamide Formula: C14H10ClN5O3S MolecularWeight: 363.7789

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C(=O)N)[N+](=O)[O-])CSC2=NC3=NC=C(C=C3N2)Cl

Isomeric SMILES

C1=CC(=C(C=C1C(=O)N)[N+](=O)[O-])CSC2=NC3=NC=C(C=C3N2)Cl

InChI

InChI=1S/C14H10ClN5O3S/c15-9-4-10-13(17-5-9)19-14(18-10)24-6-8-2-1-7(12(16)21)3-11(8)20(22)23/h1-5H,6H2,(H2,16,21)(H,17,18,19)