(phenylmethyl) N-azanyl-N'-phenyl-carbamimidothioate hydrochloride

Systemtic Name: (phenylmethyl) N-azanyl-N'-phenyl-carbamimidothioate hydrochloride Openeye Name: 1-amino-2-benzyl-3-phenyl-isothiourea hydrochloride CAS Name: N-amino-N'-phenylcarbamimidothioic acid (phenylmethyl) ester hydrochloride IUPAC Name: benzyl N-amino-N'-phenylcarbamimidothioate hydrochloride Traditional Name: 1-amino-2-benzyl-3-phenyl-isothiourea hydrochloride Formula: C14H16ClN3S MolecularWeight: 293.81494

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSC(=NC2=CC=CC=C2)NN.Cl

Isomeric SMILES

C1=CC=C(C=C1)CSC(=NC2=CC=CC=C2)NN.Cl

InChI

InChI=1S/C14H15N3S.ClH/c15-17-14(16-13-9-5-2-6-10-13)18-11-12-7-3-1-4-8-12;/h1-10H,11,15H2,(H,16,17);1H