2-azanylethyl N'-phenylcarbamimidothioate dihydrobromide

Systemtic Name: 2-azanylethyl N'-phenylcarbamimidothioate dihydrobromide Openeye Name: 2-(2-aminoethyl)-3-phenyl-isothiourea dihydrobromide CAS Name: N'-phenylcarbamimidothioic acid 2-aminoethyl ester dihydrobromide IUPAC Name: 2-aminoethyl N'-phenylcarbamimidothioate dihydrobromide Traditional Name: 2-(2-aminoethyl)-3-phenyl-isothiourea dihydrobromide Formula: C9H15Br2N3S MolecularWeight: 357.1085

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N=C(N)SCCN.Br.Br

Isomeric SMILES

C1=CC=C(C=C1)N=C(N)SCCN.Br.Br

InChI

InChI=1S/C9H13N3S.2BrH/c10-6-7-13-9(11)12-8-4-2-1-3-5-8;;/h1-5H,6-7,10H2,(H2,11,12);2*1H