(2R)-N-(1-cyanocyclohexyl)-2-[(6-oxidanylidene-1H-pyrimidin-2-yl)sulfanyl]propanamide

Systemtic Name: (2R)-N-(1-cyanocyclohexyl)-2-[(6-oxidanylidene-1H-pyrimidin-2-yl)sulfanyl]propanamide Openeye Name: (2R)-N-(1-cyanocyclohexyl)-2-[(6-oxo-1H-pyrimidin-2-yl)sulfanyl]propanamide CAS Name: (2R)-N-(1-cyanocyclohexyl)-2-[(6-oxo-1H-pyrimidin-2-yl)thio]propanamide IUPAC Name: (2R)-N-(1-cyanocyclohexyl)-2-[(6-oxo-1H-pyrimidin-2-yl)sulfanyl]propanamide Traditional Name: (2R)-N-(1-cyanocyclohexyl)-2-[(6-keto-1H-pyrimidin-2-yl)thio]propionamide Formula: C14H18N4O2S MolecularWeight: 306.38332

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1(CCCCC1)C#N)SC2=NC=CC(=O)N2

Isomeric SMILES

C[C@H](C(=O)NC1(CCCCC1)C#N)SC2=NC=CC(=O)N2

InChI

InChI=1S/C14H18N4O2S/c1-10(21-13-16-8-5-11(19)17-13)12(20)18-14(9-15)6-3-2-4-7-14/h5,8,10H,2-4,6-7H2,1H3,(H,18,20)(H,16,17,19)/t10-/m1/s1