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

Systemtic Name: 6,7-dimethoxy-N-[6-methyl-2,4-bis(methylsulfanyl)pyridin-3-yl]-3,4-dihydro-1H-isothiochromene-1-carboxamide Openeye Name: 6,7-dimethoxy-N-[6-methyl-2,4-bis(methylsulfanyl)-3-pyridyl]isothiochromane-1-carboxamide CAS Name: 6,7-dimethoxy-N-[6-methyl-2,4-bis(methylthio)-3-pyridinyl]-3,4-dihydro-1H-2-benzothiopyran-1-carboxamide IUPAC Name: 6,7-dimethoxy-N-[6-methyl-2,4-bis(methylsulfanyl)pyridin-3-yl]-3,4-dihydro-1H-isothiochromene-1-carboxamide Traditional Name: 6,7-dimethoxy-N-[6-methyl-2,4-bis(methylthio)-3-pyridyl]isothiochroman-1-carboxamide Formula: C20H24N2O3S3 MolecularWeight: 436.61116

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(C(=C1)SC)NC(=O)C2C3=CC(=C(C=C3CCS2)OC)OC)SC

Isomeric SMILES

CC1=NC(=C(C(=C1)SC)NC(=O)C2C3=CC(=C(C=C3CCS2)OC)OC)SC

InChI

InChI=1S/C20H24N2O3S3/c1-11-8-16(26-4)17(20(21-11)27-5)22-19(23)18-13-10-15(25-3)14(24-2)9-12(13)6-7-28-18/h8-10,18H,6-7H2,1-5H3,(H,22,23)