2-phenylazanylethyl carbamimidothioate dihydrobromide

Systemtic Name: 2-phenylazanylethyl carbamimidothioate dihydrobromide Openeye Name: 2-(2-anilinoethyl)isothiourea dihydrobromide CAS Name: carbamimidothioic acid 2-anilinoethyl ester dihydrobromide IUPAC Name: 2-anilinoethyl carbamimidothioate dihydrobromide Traditional Name: 2-(2-anilinoethyl)isothiourea dihydrobromide Formula: C9H15Br2N3S MolecularWeight: 357.1085

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H13N3S.2BrH/c10-9(11)13-7-6-12-8-4-2-1-3-5-8;;/h1-5,12H,6-7H2,(H3,10,11);2*1H