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

Systemtic Name: [6-tert-butyl-2-[6-(dimethylamino)hexylsulfanyl]pyridin-3-yl]-thiophen-2-yl-methanone Openeye Name: [6-tert-butyl-2-[6-(dimethylamino)hexylsulfanyl]-3-pyridyl]-(2-thienyl)methanone CAS Name: [6-tert-butyl-2-[6-(dimethylamino)hexylthio]-3-pyridinyl]-thiophen-2-ylmethanone IUPAC Name: [6-tert-butyl-2-[6-(dimethylamino)hexylsulfanyl]pyridin-3-yl]-thiophen-2-ylmethanone Traditional Name: [6-tert-butyl-2-[6-(dimethylamino)hexylthio]-3-pyridyl]-(2-thienyl)methanone Formula: C22H32N2OS2 MolecularWeight: 404.63228

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H32N2OS2/c1-22(2,3)19-13-12-17(20(25)18-11-10-16-26-18)21(23-19)27-15-9-7-6-8-14-24(4)5/h10-13,16H,6-9,14-15H2,1-5H3