[2-[6-(dimethylamino)hexylsulfanyl]-6-(3-methylbutyl)pyridin-3-yl]-thiophen-2-yl-methanone

Systemtic Name: [2-[6-(dimethylamino)hexylsulfanyl]-6-(3-methylbutyl)pyridin-3-yl]-thiophen-2-yl-methanone Openeye Name: [2-[6-(dimethylamino)hexylsulfanyl]-6-isopentyl-3-pyridyl]-(2-thienyl)methanone CAS Name: [2-[6-(dimethylamino)hexylthio]-6-(3-methylbutyl)-3-pyridinyl]-thiophen-2-ylmethanone IUPAC Name: [2-[6-(dimethylamino)hexylsulfanyl]-6-(3-methylbutyl)pyridin-3-yl]-thiophen-2-ylmethanone Traditional Name: [2-[6-(dimethylamino)hexylthio]-6-isoamyl-3-pyridyl]-(2-thienyl)methanone Formula: C23H34N2OS2 MolecularWeight: 418.65886

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCC1=NC(=C(C=C1)C(=O)C2=CC=CS2)SCCCCCCN(C)C

Isomeric SMILES

CC(C)CCC1=NC(=C(C=C1)C(=O)C2=CC=CS2)SCCCCCCN(C)C

InChI

InChI=1S/C23H34N2OS2/c1-18(2)11-12-19-13-14-20(22(26)21-10-9-17-27-21)23(24-19)28-16-8-6-5-7-15-25(3)4/h9-10,13-14,17-18H,5-8,11-12,15-16H2,1-4H3