[(1S,2S)-2-(dimethylamino)-1-phenyl-propyl] carbamimidothioate dihydrochloride

Systemtic Name: [(1S,2S)-2-(dimethylamino)-1-phenyl-propyl] carbamimidothioate dihydrochloride Openeye Name: 2-[(1S,2S)-2-(dimethylamino)-1-phenyl-propyl]isothiourea dihydrochloride CAS Name: carbamimidothioic acid [(1S,2S)-2-(dimethylamino)-1-phenylpropyl] ester dihydrochloride IUPAC Name: [(1S,2S)-2-(dimethylamino)-1-phenylpropyl] carbamimidothioate dihydrochloride Traditional Name: 2-[(1S,2S)-2-(dimethylamino)-1-phenyl-propyl]isothiourea dihydrochloride Formula: C12H21Cl2N3S MolecularWeight: 310.28624

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C[C@@H]([C@H](C1=CC=CC=C1)SC(=N)N)N(C)C.Cl.Cl

InChI

InChI=1S/C12H19N3S.2ClH/c1-9(15(2)3)11(16-12(13)14)10-7-5-4-6-8-10;;/h4-9,11H,1-3H3,(H3,13,14);2*1H/t9-,11+;;/m0../s1