[3,5-bis(chloranyl)-2-oxidanyl-phenyl]methyl carbamimidothioate

Systemtic Name: [3,5-bis(chloranyl)-2-oxidanyl-phenyl]methyl carbamimidothioate Openeye Name: 2-[(3,5-dichloro-2-hydroxy-phenyl)methyl]isothiourea CAS Name: carbamimidothioic acid (3,5-dichloro-2-hydroxyphenyl)methyl ester IUPAC Name: (3,5-dichloro-2-hydroxyphenyl)methyl carbamimidothioate Traditional Name: 2-(3,5-dichloro-2-hydroxy-benzyl)isothiourea Formula: C8H8Cl2N2OS MolecularWeight: 251.13292

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=C(C(=C1Cl)O)CSC(=N)N)Cl

Isomeric SMILES

C1=C(C=C(C(=C1Cl)O)CSC(=N)N)Cl

InChI

InChI=1S/C8H8Cl2N2OS/c9-5-1-4(3-14-8(11)12)7(13)6(10)2-5/h1-2,13H,3H2,(H3,11,12)