(5R)-3-phenethyl-N-[(2-phenyl-1,2,3-triazol-4-yl)methyl]-4,5-dihydro-1,2-oxazole-5-carboxamide

Systemtic Name: (5R)-3-phenethyl-N-[(2-phenyl-1,2,3-triazol-4-yl)methyl]-4,5-dihydro-1,2-oxazole-5-carboxamide Openeye Name: (5R)-3-phenethyl-N-[(2-phenyltriazol-4-yl)methyl]-4,5-dihydroisoxazole-5-carboxamide CAS Name: (5R)-3-phenethyl-N-[(2-phenyl-4-triazolyl)methyl]-4,5-dihydroisoxazole-5-carboxamide IUPAC Name: (5R)-3-phenethyl-N-[(2-phenyltriazol-4-yl)methyl]-4,5-dihydro-1,2-oxazole-5-carboxamide Traditional Name: (5R)-3-phenethyl-N-[(2-phenyltriazol-4-yl)methyl]-2-isoxazoline-5-carboxamide Formula: C21H21N5O2 MolecularWeight: 375.42374

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Descriptors Computed from Structure

Canonical SMILES:

C1C(ON=C1CCC2=CC=CC=C2)C(=O)NCC3=NN(N=C3)C4=CC=CC=C4

Isomeric SMILES

C1[C@@H](ON=C1CCC2=CC=CC=C2)C(=O)NCC3=NN(N=C3)C4=CC=CC=C4

InChI

InChI=1S/C21H21N5O2/c27-21(20-13-17(25-28-20)12-11-16-7-3-1-4-8-16)22-14-18-15-23-26(24-18)19-9-5-2-6-10-19/h1-10,15,20H,11-14H2,(H,22,27)/t20-/m1/s1