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

Systemtic Name: N-[4-(1-methylimidazol-2-yl)sulfanylphenyl]-3-methylsulfonyl-benzamide Openeye Name: N-[4-(1-methylimidazol-2-yl)sulfanylphenyl]-3-methylsulfonyl-benzamide CAS Name: N-[4-[(1-methyl-2-imidazolyl)thio]phenyl]-3-methylsulfonylbenzamide IUPAC Name: N-[4-(1-methylimidazol-2-yl)sulfanylphenyl]-3-methylsulfonylbenzamide Traditional Name: 3-mesyl-N-[4-[(1-methylimidazol-2-yl)thio]phenyl]benzamide Formula: C18H17N3O3S2 MolecularWeight: 387.47588

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CN=C1SC2=CC=C(C=C2)NC(=O)C3=CC(=CC=C3)S(=O)(=O)C

Isomeric SMILES

CN1C=CN=C1SC2=CC=C(C=C2)NC(=O)C3=CC(=CC=C3)S(=O)(=O)C

InChI

InChI=1S/C18H17N3O3S2/c1-21-11-10-19-18(21)25-15-8-6-14(7-9-15)20-17(22)13-4-3-5-16(12-13)26(2,23)24/h3-12H,1-2H3,(H,20,22)