phenyl N'-(phenylmethyl)carbamimidothioate hydrochloride

Systemtic Name: phenyl N'-(phenylmethyl)carbamimidothioate hydrochloride Openeye Name: 3-benzyl-2-phenyl-isothiourea hydrochloride CAS Name: N'-(phenylmethyl)carbamimidothioic acid phenyl ester hydrochloride IUPAC Name: phenyl N'-benzylcarbamimidothioate hydrochloride Traditional Name: 3-benzyl-2-phenyl-isothiourea hydrochloride Formula: C14H15ClN2S MolecularWeight: 278.8003

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN=C(N)SC2=CC=CC=C2.Cl

Isomeric SMILES

C1=CC=C(C=C1)CN=C(N)SC2=CC=CC=C2.Cl

InChI

InChI=1S/C14H14N2S.ClH/c15-14(17-13-9-5-2-6-10-13)16-11-12-7-3-1-4-8-12;/h1-10H,11H2,(H2,15,16);1H