N'-pyridin-3-yl-N-[4-(2-sulfanylethylamino)butyl]ethanediamide dihydrochloride

Systemtic Name: N'-pyridin-3-yl-N-[4-(2-sulfanylethylamino)butyl]ethanediamide dihydrochloride Openeye Name: N'-(3-pyridyl)-N-[4-(2-sulfanylethylamino)butyl]oxamide dihydrochloride CAS Name: N-[4-(2-mercaptoethylamino)butyl]-N'-(3-pyridinyl)oxamide dihydrochloride IUPAC Name: N'-pyridin-3-yl-N-[4-(2-sulfanylethylamino)butyl]oxamide dihydrochloride Traditional Name: N-[4-(2-mercaptoethylamino)butyl]-N'-(3-pyridyl)oxamide dihydrochloride Formula: C13H22Cl2N4O2S MolecularWeight: 369.31038

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)NC(=O)C(=O)NCCCCNCCS.Cl.Cl

Isomeric SMILES

C1=CC(=CN=C1)NC(=O)C(=O)NCCCCNCCS.Cl.Cl

InChI

InChI=1S/C13H20N4O2S.2ClH/c18-12(16-7-2-1-5-14-8-9-20)13(19)17-11-4-3-6-15-10-11;;/h3-4,6,10,14,20H,1-2,5,7-9H2,(H,16,18)(H,17,19);2*1H