(4-cyanophenyl)methyl N'-phenylcarbamimidothioate

Systemtic Name: (4-cyanophenyl)methyl N'-phenylcarbamimidothioate Openeye Name: 2-[(4-cyanophenyl)methyl]-3-phenyl-isothiourea CAS Name: N'-phenylcarbamimidothioic acid (4-cyanophenyl)methyl ester IUPAC Name: (4-cyanophenyl)methyl N'-phenylcarbamimidothioate Traditional Name: 2-(4-cyanobenzyl)-3-phenyl-isothiourea Formula: C15H13N3S MolecularWeight: 267.34882

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N=C(N)SCC2=CC=C(C=C2)C#N

Isomeric SMILES

C1=CC=C(C=C1)N=C(N)SCC2=CC=C(C=C2)C#N

InChI

InChI=1S/C15H13N3S/c16-10-12-6-8-13(9-7-12)11-19-15(17)18-14-4-2-1-3-5-14/h1-9H,11H2,(H2,17,18)