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

Systemtic Name: [2-[6-(dimethylamino)hexylsulfanyl]-6-propan-2-yloxy-pyridin-3-yl]-thiophen-2-yl-methanone Openeye Name: [2-[6-(dimethylamino)hexylsulfanyl]-6-isopropoxy-3-pyridyl]-(2-thienyl)methanone CAS Name: [2-[6-(dimethylamino)hexylthio]-6-propan-2-yloxy-3-pyridinyl]-thiophen-2-ylmethanone IUPAC Name: [2-[6-(dimethylamino)hexylsulfanyl]-6-propan-2-yloxypyridin-3-yl]-thiophen-2-ylmethanone Traditional Name: [2-[6-(dimethylamino)hexylthio]-6-isopropoxy-3-pyridyl]-(2-thienyl)methanone Formula: C21H30N2O2S2 MolecularWeight: 406.6051

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=NC(=C(C=C1)C(=O)C2=CC=CS2)SCCCCCCN(C)C

Isomeric SMILES

CC(C)OC1=NC(=C(C=C1)C(=O)C2=CC=CS2)SCCCCCCN(C)C

InChI

InChI=1S/C21H30N2O2S2/c1-16(2)25-19-12-11-17(20(24)18-10-9-15-26-18)21(22-19)27-14-8-6-5-7-13-23(3)4/h9-12,15-16H,5-8,13-14H2,1-4H3