(2S)-N-(2-cyanophenyl)-2-(1-cyclopropyl-5-phenyl-imidazol-2-yl)sulfanyl-propanamide

Systemtic Name: (2S)-N-(2-cyanophenyl)-2-(1-cyclopropyl-5-phenyl-imidazol-2-yl)sulfanyl-propanamide Openeye Name: (2S)-N-(2-cyanophenyl)-2-(1-cyclopropyl-5-phenyl-imidazol-2-yl)sulfanyl-propanamide CAS Name: (2S)-N-(2-cyanophenyl)-2-[(1-cyclopropyl-5-phenyl-2-imidazolyl)thio]propanamide IUPAC Name: (2S)-N-(2-cyanophenyl)-2-(1-cyclopropyl-5-phenylimidazol-2-yl)sulfanylpropanamide Traditional Name: (2S)-N-(2-cyanophenyl)-2-[(1-cyclopropyl-5-phenyl-imidazol-2-yl)thio]propionamide Formula: C22H20N4OS MolecularWeight: 388.4854

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC=C1C#N)SC2=NC=C(N2C3CC3)C4=CC=CC=C4

Isomeric SMILES

C[C@@H](C(=O)NC1=CC=CC=C1C#N)SC2=NC=C(N2C3CC3)C4=CC=CC=C4

InChI

InChI=1S/C22H20N4OS/c1-15(21(27)25-19-10-6-5-9-17(19)13-23)28-22-24-14-20(26(22)18-11-12-18)16-7-3-2-4-8-16/h2-10,14-15,18H,11-12H2,1H3,(H,25,27)/t15-/m0/s1