[2-[1-[6-(dimethylamino)hexylsulfanyl]propan-2-ylsulfanyl]pyridin-3-yl]-thiophen-2-yl-methanone

Systemtic Name: [2-[1-[6-(dimethylamino)hexylsulfanyl]propan-2-ylsulfanyl]pyridin-3-yl]-thiophen-2-yl-methanone Openeye Name: [2-[2-[6-(dimethylamino)hexylsulfanyl]-1-methyl-ethyl]sulfanyl-3-pyridyl]-(2-thienyl)methanone CAS Name: [2-[1-[6-(dimethylamino)hexylthio]propan-2-ylthio]-3-pyridinyl]-thiophen-2-ylmethanone IUPAC Name: [2-[1-[6-(dimethylamino)hexylsulfanyl]propan-2-ylsulfanyl]pyridin-3-yl]-thiophen-2-ylmethanone Traditional Name: [2-[[2-[6-(dimethylamino)hexylthio]-1-methyl-ethyl]thio]-3-pyridyl]-(2-thienyl)methanone Formula: C21H30N2OS3 MolecularWeight: 422.6707

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Descriptors Computed from Structure

Canonical SMILES:

CC(CSCCCCCCN(C)C)SC1=C(C=CC=N1)C(=O)C2=CC=CS2

Isomeric SMILES

CC(CSCCCCCCN(C)C)SC1=C(C=CC=N1)C(=O)C2=CC=CS2

InChI

InChI=1S/C21H30N2OS3/c1-17(16-25-14-7-5-4-6-13-23(2)3)27-21-18(10-8-12-22-21)20(24)19-11-9-15-26-19/h8-12,15,17H,4-7,13-14,16H2,1-3H3