methyl N'-[(E)-C-phenyl-N-(phenylsulfonyl)carbonimidoyl]carbamimidothioate

Systemtic Name: methyl N'-[(E)-C-phenyl-N-(phenylsulfonyl)carbonimidoyl]carbamimidothioate Openeye Name: 3-[(E)-N-(benzenesulfonyl)-C-phenyl-carbonimidoyl]-2-methyl-isothiourea CAS Name: N'-[(E)-benzenesulfonylimino(phenyl)methyl]carbamimidothioic acid methyl ester IUPAC Name: methyl N'-[(E)-N-(benzenesulfonyl)-C-phenylcarbonimidoyl]carbamimidothioate Traditional Name: 3-[(E)-N-besyl-C-phenyl-carbonimidoyl]-2-methyl-isothiourea Formula: C15H15N3O2S2 MolecularWeight: 333.4285

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSC(=NC(=NS(=O)(=O)C1=CC=CC=C1)C2=CC=CC=C2)N

Isomeric SMILES

CSC(=N/C(=N/S(=O)(=O)C1=CC=CC=C1)/C2=CC=CC=C2)N

InChI

InChI=1S/C15H15N3O2S2/c1-21-15(16)17-14(12-8-4-2-5-9-12)18-22(19,20)13-10-6-3-7-11-13/h2-11H,1H3,(H2,16,17,18)