(phenylmethyl) N'-(cyclohexylideneamino)carbamimidothioate hydrochloride

Systemtic Name: (phenylmethyl) N'-(cyclohexylideneamino)carbamimidothioate hydrochloride Openeye Name: 2-benzyl-3-(cyclohexylideneamino)isothiourea hydrochloride CAS Name: N'-(cyclohexylideneamino)carbamimidothioic acid (phenylmethyl) ester hydrochloride IUPAC Name: benzyl N'-(cyclohexylideneamino)carbamimidothioate hydrochloride Traditional Name: 2-benzyl-3-(cyclohexylideneamino)isothiourea hydrochloride Formula: C14H20ClN3S MolecularWeight: 297.8467

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=NN=C(N)SCC2=CC=CC=C2)CC1.Cl

Isomeric SMILES

C1CCC(=N/N=C(\N)/SCC2=CC=CC=C2)CC1.Cl

InChI

InChI=1S/C14H19N3S.ClH/c15-14(17-16-13-9-5-2-6-10-13)18-11-12-7-3-1-4-8-12;/h1,3-4,7-8H,2,5-6,9-11H2,(H2,15,17);1H