5-(2-chloranylethanoylamino)-4-phenyl-4-(phenylmethyl)-3-pyridin-3-yl-1,2-oxazole-5-carboxamide

Systemtic Name: 5-(2-chloranylethanoylamino)-4-phenyl-4-(phenylmethyl)-3-pyridin-3-yl-1,2-oxazole-5-carboxamide Openeye Name: 4-benzyl-5-[(2-chloroacetyl)amino]-4-phenyl-3-(3-pyridyl)isoxazole-5-carboxamide CAS Name: 5-[(2-chloro-1-oxoethyl)amino]-4-phenyl-4-(phenylmethyl)-3-(3-pyridinyl)-5-isoxazolecarboxamide IUPAC Name: 4-benzyl-5-[(2-chloroacetyl)amino]-4-phenyl-3-pyridin-3-yl-1,2-oxazole-5-carboxamide Traditional Name: 4-benzyl-5-[(2-chloroacetyl)amino]-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)CC2(C(=NOC2(C(=O)N)NC(=O)CCl)C3=CN=CC=C3)C4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)CC2(C(=NOC2(C(=O)N)NC(=O)CCl)C3=CN=CC=C3)C4=CC=CC=C4

InChI

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