6,7-dimethoxy-N-[6-methyl-2,4-bis(methylsulfanyl)pyridin-3-yl]-4-pentyl-3,4-dihydro-1H-isothiochromene-1-carboxamide

Systemtic Name: 6,7-dimethoxy-N-[6-methyl-2,4-bis(methylsulfanyl)pyridin-3-yl]-4-pentyl-3,4-dihydro-1H-isothiochromene-1-carboxamide Openeye Name: 6,7-dimethoxy-N-[6-methyl-2,4-bis(methylsulfanyl)-3-pyridyl]-4-pentyl-isothiochromane-1-carboxamide CAS Name: 6,7-dimethoxy-N-[6-methyl-2,4-bis(methylthio)-3-pyridinyl]-4-pentyl-3,4-dihydro-1H-2-benzothiopyran-1-carboxamide IUPAC Name: 6,7-dimethoxy-N-[6-methyl-2,4-bis(methylsulfanyl)pyridin-3-yl]-4-pentyl-3,4-dihydro-1H-isothiochromene-1-carboxamide Traditional Name: 4-amyl-6,7-dimethoxy-N-[6-methyl-2,4-bis(methylthio)-3-pyridyl]isothiochroman-1-carboxamide Formula: C25H34N2O3S3 MolecularWeight: 506.74406

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1CSC(C2=CC(=C(C=C12)OC)OC)C(=O)NC3=C(N=C(C=C3SC)C)SC

Isomeric SMILES

CCCCCC1CSC(C2=CC(=C(C=C12)OC)OC)C(=O)NC3=C(N=C(C=C3SC)C)SC

InChI

InChI=1S/C25H34N2O3S3/c1-7-8-9-10-16-14-33-23(18-13-20(30-4)19(29-3)12-17(16)18)24(28)27-22-21(31-5)11-15(2)26-25(22)32-6/h11-13,16,23H,7-10,14H2,1-6H3,(H,27,28)