4-(4-phenylbutylsulfanyl)pyridine; propanamide; dihydrochloride

Systemtic Name: 4-(4-phenylbutylsulfanyl)pyridine; propanamide; dihydrochloride Openeye Name: 4-(4-phenylbutylsulfanyl)pyridine; propanamide; dihydrochloride CAS Name: 4-(4-phenylbutylthio)pyridine; propanamide; dihydrochloride IUPAC Name: 4-(4-phenylbutylsulfanyl)pyridine; propanamide; dihydrochloride Traditional Name: 4-(4-phenylbutylthio)pyridine; propionamide; dihydrochloride Formula: C18H26Cl2N2OS MolecularWeight: 389.38284

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N.C1=CC=C(C=C1)CCCCSC2=CC=NC=C2.Cl.Cl

Isomeric SMILES

CCC(=O)N.C1=CC=C(C=C1)CCCCSC2=CC=NC=C2.Cl.Cl

InChI

InChI=1S/C15H17NS.C3H7NO.2ClH/c1-2-6-14(7-3-1)8-4-5-13-17-15-9-11-16-12-10-15;1-2-3(4)5;;/h1-3,6-7,9-12H,4-5,8,13H2;2H2,1H3,(H2,4,5);2*1H