2-[bis(phenylmethyl)amino]ethyl carbamimidothioate dihydrochloride

Systemtic Name: 2-[bis(phenylmethyl)amino]ethyl carbamimidothioate dihydrochloride Openeye Name: 2-[2-(dibenzylamino)ethyl]isothiourea dihydrochloride CAS Name: carbamimidothioic acid 2-[bis(phenylmethyl)amino]ethyl ester dihydrochloride IUPAC Name: 2-(dibenzylamino)ethyl carbamimidothioate dihydrochloride Traditional Name: 2-[2-(dibenzylamino)ethyl]isothiourea dihydrochloride Formula: C17H23Cl2N3S MolecularWeight: 372.35562

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN(CCSC(=N)N)CC2=CC=CC=C2.Cl.Cl

Isomeric SMILES

C1=CC=C(C=C1)CN(CCSC(=N)N)CC2=CC=CC=C2.Cl.Cl

InChI

InChI=1S/C17H21N3S.2ClH/c18-17(19)21-12-11-20(13-15-7-3-1-4-8-15)14-16-9-5-2-6-10-16;;/h1-10H,11-14H2,(H3,18,19);2*1H