4-methyl-5-(4-phenylbutylsulfanyl)-1,3-thiazol-2-amine; propan-1-amine; hydrochloride

Systemtic Name: 4-methyl-5-(4-phenylbutylsulfanyl)-1,3-thiazol-2-amine; propan-1-amine; hydrochloride Openeye Name: 4-methyl-5-(4-phenylbutylsulfanyl)thiazol-2-amine; propan-1-amine; hydrochloride CAS Name: 4-methyl-5-(4-phenylbutylthio)-2-thiazolamine; 1-propanamine; hydrochloride IUPAC Name: 4-methyl-5-(4-phenylbutylsulfanyl)-1,3-thiazol-2-amine; propan-1-amine; hydrochloride Traditional Name: [4-methyl-5-(4-phenylbutylthio)thiazol-2-yl]amine; propylamine; hydrochloride Formula: C17H28ClN3S2 MolecularWeight: 374.00732

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCN.CC1=C(SC(=N1)N)SCCCCC2=CC=CC=C2.Cl

Isomeric SMILES

CCCN.CC1=C(SC(=N1)N)SCCCCC2=CC=CC=C2.Cl

InChI

InChI=1S/C14H18N2S2.C3H9N.ClH/c1-11-13(18-14(15)16-11)17-10-6-5-9-12-7-3-2-4-8-12;1-2-3-4;/h2-4,7-8H,5-6,9-10H2,1H3,(H2,15,16);2-4H2,1H3;1H