[2-[bis(chloranyl)amino]-1-phenyl-ethyl] carbamimidothioate dihydrochloride

Systemtic Name: [2-[bis(chloranyl)amino]-1-phenyl-ethyl] carbamimidothioate dihydrochloride Openeye Name: 2-[2-(dichloroamino)-1-phenyl-ethyl]isothiourea dihydrochloride CAS Name: carbamimidothioic acid [2-(dichloroamino)-1-phenylethyl] ester dihydrochloride IUPAC Name: [2-(dichloroamino)-1-phenylethyl] carbamimidothioate dihydrochloride Traditional Name: 2-[2-(dichloroamino)-1-phenyl-ethyl]isothiourea dihydrochloride Formula: C9H13Cl4N3S MolecularWeight: 337.09662

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(CN(Cl)Cl)SC(=N)N.Cl.Cl

Isomeric SMILES

C1=CC=C(C=C1)C(CN(Cl)Cl)SC(=N)N.Cl.Cl

InChI

InChI=1S/C9H11Cl2N3S.2ClH/c10-14(11)6-8(15-9(12)13)7-4-2-1-3-5-7;;/h1-5,8H,6H2,(H3,12,13);2*1H