4-methoxy-N-[4-(1-methylimidazol-2-yl)sulfanylphenyl]-3-nitro-benzamide

Systemtic Name: 4-methoxy-N-[4-(1-methylimidazol-2-yl)sulfanylphenyl]-3-nitro-benzamide Openeye Name: 4-methoxy-N-[4-(1-methylimidazol-2-yl)sulfanylphenyl]-3-nitro-benzamide CAS Name: 4-methoxy-N-[4-[(1-methyl-2-imidazolyl)thio]phenyl]-3-nitrobenzamide IUPAC Name: 4-methoxy-N-[4-(1-methylimidazol-2-yl)sulfanylphenyl]-3-nitrobenzamide Traditional Name: 4-methoxy-N-[4-[(1-methylimidazol-2-yl)thio]phenyl]-3-nitro-benzamide Formula: C18H16N4O4S MolecularWeight: 384.40904

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H16N4O4S/c1-21-10-9-19-18(21)27-14-6-4-13(5-7-14)20-17(23)12-3-8-16(26-2)15(11-12)22(24)25/h3-11H,1-2H3,(H,20,23)