6-cyclohexyl-4-oxidanylidene-N-pyridin-3-yl-1H-isothiochromene-1-carboxamide

Systemtic Name: 6-cyclohexyl-4-oxidanylidene-N-pyridin-3-yl-1H-isothiochromene-1-carboxamide Openeye Name: 6-cyclohexyl-4-oxo-N-(3-pyridyl)isothiochromane-1-carboxamide CAS Name: 6-cyclohexyl-4-oxo-N-(3-pyridinyl)-1H-2-benzothiopyran-1-carboxamide IUPAC Name: 6-cyclohexyl-4-oxo-N-pyridin-3-yl-1H-isothiochromene-1-carboxamide Traditional Name: 6-cyclohexyl-4-keto-N-(3-pyridyl)isothiochroman-1-carboxamide Formula: C21H22N2O2S MolecularWeight: 366.47658

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C2=CC3=C(C=C2)C(SCC3=O)C(=O)NC4=CN=CC=C4

Isomeric SMILES

C1CCC(CC1)C2=CC3=C(C=C2)C(SCC3=O)C(=O)NC4=CN=CC=C4

InChI

InChI=1S/C21H22N2O2S/c24-19-13-26-20(21(25)23-16-7-4-10-22-12-16)17-9-8-15(11-18(17)19)14-5-2-1-3-6-14/h4,7-12,14,20H,1-3,5-6,13H2,(H,23,25)