2-(phenylsulfanylmethyl)pentane-1,5-diamine dihydrochloride

Systemtic Name: 2-(phenylsulfanylmethyl)pentane-1,5-diamine dihydrochloride Openeye Name: 2-(phenylsulfanylmethyl)pentane-1,5-diamine dihydrochloride CAS Name: 2-[(phenylthio)methyl]pentane-1,5-diamine dihydrochloride IUPAC Name: 2-(phenylsulfanylmethyl)pentane-1,5-diamine dihydrochloride Traditional Name: [4-(aminomethyl)-5-(phenylthio)pentyl]amine dihydrochloride Formula: C12H22Cl2N2S MolecularWeight: 297.28748

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)SCC(CCCN)CN.Cl.Cl

Isomeric SMILES

C1=CC=C(C=C1)SCC(CCCN)CN.Cl.Cl

InChI

InChI=1S/C12H20N2S.2ClH/c13-8-4-5-11(9-14)10-15-12-6-2-1-3-7-12;;/h1-3,6-7,11H,4-5,8-10,13-14H2;2*1H