2-chloranyl-N-[4-(1-methylimidazol-2-yl)sulfanylphenyl]-4-nitro-benzamide

Systemtic Name: 2-chloranyl-N-[4-(1-methylimidazol-2-yl)sulfanylphenyl]-4-nitro-benzamide Openeye Name: 2-chloro-N-[4-(1-methylimidazol-2-yl)sulfanylphenyl]-4-nitro-benzamide CAS Name: 2-chloro-N-[4-[(1-methyl-2-imidazolyl)thio]phenyl]-4-nitrobenzamide IUPAC Name: 2-chloro-N-[4-(1-methylimidazol-2-yl)sulfanylphenyl]-4-nitrobenzamide Traditional Name: 2-chloro-N-[4-[(1-methylimidazol-2-yl)thio]phenyl]-4-nitro-benzamide Formula: C17H13ClN4O3S MolecularWeight: 388.82812

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CN=C1SC2=CC=C(C=C2)NC(=O)C3=C(C=C(C=C3)[N+](=O)[O-])Cl

Isomeric SMILES

CN1C=CN=C1SC2=CC=C(C=C2)NC(=O)C3=C(C=C(C=C3)[N+](=O)[O-])Cl

InChI

InChI=1S/C17H13ClN4O3S/c1-21-9-8-19-17(21)26-13-5-2-11(3-6-13)20-16(23)14-7-4-12(22(24)25)10-15(14)18/h2-10H,1H3,(H,20,23)