(4S)-N-phenethyl-2-(4-pyridin-3-ylcarbonylphenyl)-4,5-dihydro-1,3-oxazole-4-carboxamide

Systemtic Name: (4S)-N-phenethyl-2-(4-pyridin-3-ylcarbonylphenyl)-4,5-dihydro-1,3-oxazole-4-carboxamide Openeye Name: (4S)-N-phenethyl-2-[4-(pyridine-3-carbonyl)phenyl]-4,5-dihydrooxazole-4-carboxamide CAS Name: (4S)-2-[4-[oxo(3-pyridinyl)methyl]phenyl]-N-phenethyl-4,5-dihydrooxazole-4-carboxamide IUPAC Name: (4S)-N-phenethyl-2-[4-(pyridine-3-carbonyl)phenyl]-4,5-dihydro-1,3-oxazole-4-carboxamide Traditional Name: (4S)-2-(4-nicotinoylphenyl)-N-phenethyl-2-oxazoline-4-carboxamide Formula: C24H21N3O3 MolecularWeight: 399.44184

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Descriptors Computed from Structure

Canonical SMILES:

C1C(N=C(O1)C2=CC=C(C=C2)C(=O)C3=CN=CC=C3)C(=O)NCCC4=CC=CC=C4

Isomeric SMILES

C1[C@H](N=C(O1)C2=CC=C(C=C2)C(=O)C3=CN=CC=C3)C(=O)NCCC4=CC=CC=C4

InChI

InChI=1S/C24H21N3O3/c28-22(20-7-4-13-25-15-20)18-8-10-19(11-9-18)24-27-21(16-30-24)23(29)26-14-12-17-5-2-1-3-6-17/h1-11,13,15,21H,12,14,16H2,(H,26,29)/t21-/m0/s1