(2S)-2-(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanyl-N-(2-oxidanylidene-1,3-dihydrobenzimidazol-5-yl)propanamide

Systemtic Name: (2S)-2-(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanyl-N-(2-oxidanylidene-1,3-dihydrobenzimidazol-5-yl)propanamide Openeye Name: (2S)-2-(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanyl-N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)propanamide CAS Name: (2S)-2-[(4-methyl-6-phenyl-2-pyrimidinyl)thio]-N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)propanamide IUPAC Name: (2S)-2-(4-methyl-6-phenylpyrimidin-2-yl)sulfanyl-N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)propanamide Traditional Name: (2S)-N-(2-keto-1,3-dihydrobenzimidazol-5-yl)-2-[(4-methyl-6-phenyl-pyrimidin-2-yl)thio]propionamide Formula: C21H19N5O2S MolecularWeight: 405.47286

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC(=C1)C2=CC=CC=C2)SC(C)C(=O)NC3=CC4=C(C=C3)NC(=O)N4

Isomeric SMILES

CC1=NC(=NC(=C1)C2=CC=CC=C2)S[C@@H](C)C(=O)NC3=CC4=C(C=C3)NC(=O)N4

InChI

InChI=1S/C21H19N5O2S/c1-12-10-17(14-6-4-3-5-7-14)26-21(22-12)29-13(2)19(27)23-15-8-9-16-18(11-15)25-20(28)24-16/h3-11,13H,1-2H3,(H,23,27)(H2,24,25,28)/t13-/m0/s1