phenacyl carbamimidothioate hydrochloride

Systemtic Name: phenacyl carbamimidothioate hydrochloride Openeye Name: 2-phenacylisothiourea hydrochloride CAS Name: carbamimidothioic acid phenacyl ester hydrochloride IUPAC Name: phenacyl carbamimidothioate hydrochloride Traditional Name: 2-phenacylisothiourea hydrochloride Formula: C9H11ClN2OS MolecularWeight: 230.71444

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)CSC(=N)N.Cl

Isomeric SMILES

C1=CC=C(C=C1)C(=O)CSC(=N)N.Cl

InChI

InChI=1S/C9H10N2OS.ClH/c10-9(11)13-6-8(12)7-4-2-1-3-5-7;/h1-5H,6H2,(H3,10,11);1H