2-methyl-N-[2-[(2-methyl-6-pyridin-4-ylsulfanyl-hexanoyl)amino]phenyl]-6-pyridin-4-ylsulfanyl-hexanamide dihydrochloride

Systemtic Name: 2-methyl-N-[2-[(2-methyl-6-pyridin-4-ylsulfanyl-hexanoyl)amino]phenyl]-6-pyridin-4-ylsulfanyl-hexanamide dihydrochloride Openeye Name: 2-methyl-N-[2-[[2-methyl-6-(4-pyridylsulfanyl)hexanoyl]amino]phenyl]-6-(4-pyridylsulfanyl)hexanamide dihydrochloride CAS Name: 2-methyl-N-[2-[[2-methyl-1-oxo-6-(pyridin-4-ylthio)hexyl]amino]phenyl]-6-(pyridin-4-ylthio)hexanamide dihydrochloride IUPAC Name: 2-methyl-N-[2-[(2-methyl-6-pyridin-4-ylsulfanylhexanoyl)amino]phenyl]-6-pyridin-4-ylsulfanylhexanamide dihydrochloride Traditional Name: 2-methyl-N-[2-[[2-methyl-6-(4-pyridylthio)hexanoyl]amino]phenyl]-6-(4-pyridylthio)hexanamide dihydrochloride Formula: C30H40Cl2N4O2S2 MolecularWeight: 623.7002

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCCCSC1=CC=NC=C1)C(=O)NC2=CC=CC=C2NC(=O)C(C)CCCCSC3=CC=NC=C3.Cl.Cl

Isomeric SMILES

CC(CCCCSC1=CC=NC=C1)C(=O)NC2=CC=CC=C2NC(=O)C(C)CCCCSC3=CC=NC=C3.Cl.Cl

InChI

InChI=1S/C30H38N4O2S2.2ClH/c1-23(9-5-7-21-37-25-13-17-31-18-14-25)29(35)33-27-11-3-4-12-28(27)34-30(36)24(2)10-6-8-22-38-26-15-19-32-20-16-26;;/h3-4,11-20,23-24H,5-10,21-22H2,1-2H3,(H,33,35)(H,34,36);2*1H