N-(4-pyridin-4-ylsulfanylbutyl)propanamide dihydrochloride

Systemtic Name: N-(4-pyridin-4-ylsulfanylbutyl)propanamide dihydrochloride Openeye Name: N-[4-(4-pyridylsulfanyl)butyl]propanamide dihydrochloride CAS Name: N-[4-(pyridin-4-ylthio)butyl]propanamide dihydrochloride IUPAC Name: N-(4-pyridin-4-ylsulfanylbutyl)propanamide dihydrochloride Traditional Name: N-[4-(4-pyridylthio)butyl]propionamide dihydrochloride Formula: C12H20Cl2N2OS MolecularWeight: 311.271

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NCCCCSC1=CC=NC=C1.Cl.Cl

Isomeric SMILES

CCC(=O)NCCCCSC1=CC=NC=C1.Cl.Cl

InChI

InChI=1S/C12H18N2OS.2ClH/c1-2-12(15)14-7-3-4-10-16-11-5-8-13-9-6-11;;/h5-6,8-9H,2-4,7,10H2,1H3,(H,14,15);2*1H