4-[4-[(3-azido-2-cyano-phenyl)methyl]phenyl]-3-pyridin-3-yl-4,5-dihydro-1,2-oxazole-5-carboxamide

Systemtic Name: 4-[4-[(3-azido-2-cyano-phenyl)methyl]phenyl]-3-pyridin-3-yl-4,5-dihydro-1,2-oxazole-5-carboxamide Openeye Name: 4-[4-[(3-azido-2-cyano-phenyl)methyl]phenyl]-3-(3-pyridyl)-4,5-dihydroisoxazole-5-carboxamide CAS Name: 4-[4-[(3-azido-2-cyanophenyl)methyl]phenyl]-3-(3-pyridinyl)-4,5-dihydroisoxazole-5-carboxamide IUPAC Name: 4-[4-[(3-azido-2-cyanophenyl)methyl]phenyl]-3-pyridin-3-yl-4,5-dihydro-1,2-oxazole-5-carboxamide Traditional Name: 4-[4-(3-azido-2-cyano-benzyl)phenyl]-3-(3-pyridyl)-2-isoxazoline-5-carboxamide Formula: C23H17N7O2 MolecularWeight: 423.42678

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C(=C1)N=[N+]=[N-])C#N)CC2=CC=C(C=C2)C3C(ON=C3C4=CN=CC=C4)C(=O)N

Isomeric SMILES

C1=CC(=C(C(=C1)N=[N+]=[N-])C#N)CC2=CC=C(C=C2)C3C(ON=C3C4=CN=CC=C4)C(=O)N

InChI

InChI=1S/C23H17N7O2/c24-12-18-16(3-1-5-19(18)28-30-26)11-14-6-8-15(9-7-14)20-21(17-4-2-10-27-13-17)29-32-22(20)23(25)31/h1-10,13,20,22H,11H2,(H2,25,31)