4-[[2-(2-chloranylethanoylamino)phenyl]methyl]-4-phenyl-3-pyridin-3-yl-5H-1,2-oxazole-5-carboxamide

Systemtic Name: 4-[[2-(2-chloranylethanoylamino)phenyl]methyl]-4-phenyl-3-pyridin-3-yl-5H-1,2-oxazole-5-carboxamide Openeye Name: 4-[[2-[(2-chloroacetyl)amino]phenyl]methyl]-4-phenyl-3-(3-pyridyl)-5H-isoxazole-5-carboxamide CAS Name: 4-[[2-[(2-chloro-1-oxoethyl)amino]phenyl]methyl]-4-phenyl-3-(3-pyridinyl)-5H-isoxazole-5-carboxamide IUPAC Name: 4-[[2-[(2-chloroacetyl)amino]phenyl]methyl]-4-phenyl-3-pyridin-3-yl-5H-1,2-oxazole-5-carboxamide Traditional Name: 4-[2-[(2-chloroacetyl)amino]benzyl]-4-phenyl-3-(3-pyridyl)-2-isoxazoline-5-carboxamide Formula: C24H21ClN4O3 MolecularWeight: 448.90154

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2(C(ON=C2C3=CN=CC=C3)C(=O)N)CC4=CC=CC=C4NC(=O)CCl

Isomeric SMILES

C1=CC=C(C=C1)C2(C(ON=C2C3=CN=CC=C3)C(=O)N)CC4=CC=CC=C4NC(=O)CCl

InChI

InChI=1S/C24H21ClN4O3/c25-14-20(30)28-19-11-5-4-7-16(19)13-24(18-9-2-1-3-10-18)21(17-8-6-12-27-15-17)29-32-22(24)23(26)31/h1-12,15,22H,13-14H2,(H2,26,31)(H,28,30)