N-[(Z)-N'-chloranylcarbamimidoyl]-3-methylsulfonyl-4-phenyl-benzenecarbothioamide

Systemtic Name: N-[(Z)-N'-chloranylcarbamimidoyl]-3-methylsulfonyl-4-phenyl-benzenecarbothioamide Openeye Name: N-[(Z)-N'-chlorocarbamimidoyl]-3-methylsulfonyl-4-phenyl-benzenecarbothioamide CAS Name: N-[(Z)-amino(chloroimino)methyl]-3-methylsulfonyl-4-phenylbenzenecarbothioamide IUPAC Name: N-[(Z)-N'-chlorocarbamimidoyl]-3-methylsulfonyl-4-phenylbenzenecarbothioamide Traditional Name: N-[(Z)-N'-chloroamidino]-3-mesyl-4-phenyl-thiobenzamide Formula: C15H14ClN3O2S2 MolecularWeight: 367.87356

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=C(C=CC(=C1)C(=S)NC(=NCl)N)C2=CC=CC=C2

Isomeric SMILES

CS(=O)(=O)C1=C(C=CC(=C1)C(=S)N/C(=N\Cl)/N)C2=CC=CC=C2

InChI

InChI=1S/C15H14ClN3O2S2/c1-23(20,21)13-9-11(14(22)18-15(17)19-16)7-8-12(13)10-5-3-2-4-6-10/h2-9H,1H3,(H3,17,18,19,22)