(2R)-N-(1-cyanocyclohexyl)-2-(4-phenylphthalazin-1-yl)sulfanyl-propanamide

Systemtic Name: (2R)-N-(1-cyanocyclohexyl)-2-(4-phenylphthalazin-1-yl)sulfanyl-propanamide Openeye Name: (2R)-N-(1-cyanocyclohexyl)-2-(4-phenylphthalazin-1-yl)sulfanyl-propanamide CAS Name: (2R)-N-(1-cyanocyclohexyl)-2-[(4-phenyl-1-phthalazinyl)thio]propanamide IUPAC Name: (2R)-N-(1-cyanocyclohexyl)-2-(4-phenylphthalazin-1-yl)sulfanylpropanamide Traditional Name: (2R)-N-(1-cyanocyclohexyl)-2-[(4-phenylphthalazin-1-yl)thio]propionamide Formula: C24H24N4OS MolecularWeight: 416.53856

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1(CCCCC1)C#N)SC2=NN=C(C3=CC=CC=C32)C4=CC=CC=C4

Isomeric SMILES

C[C@H](C(=O)NC1(CCCCC1)C#N)SC2=NN=C(C3=CC=CC=C32)C4=CC=CC=C4

InChI

InChI=1S/C24H24N4OS/c1-17(22(29)26-24(16-25)14-8-3-9-15-24)30-23-20-13-7-6-12-19(20)21(27-28-23)18-10-4-2-5-11-18/h2,4-7,10-13,17H,3,8-9,14-15H2,1H3,(H,26,29)/t17-/m1/s1