propan-2-yl 3-phenyl-3-[[4-(1,2,4-triazol-1-ylmethyl)phenyl]carbonylamino]propanoate

Systemtic Name: propan-2-yl 3-phenyl-3-[[4-(1,2,4-triazol-1-ylmethyl)phenyl]carbonylamino]propanoate Openeye Name: isopropyl 3-phenyl-3-[[4-(1,2,4-triazol-1-ylmethyl)benzoyl]amino]propanoate CAS Name: 3-[[oxo-[4-(1,2,4-triazol-1-ylmethyl)phenyl]methyl]amino]-3-phenylpropanoic acid propan-2-yl ester IUPAC Name: propan-2-yl 3-phenyl-3-[[4-(1,2,4-triazol-1-ylmethyl)benzoyl]amino]propanoate Traditional Name: 3-phenyl-3-[[4-(1,2,4-triazol-1-ylmethyl)benzoyl]amino]propionic acid isopropyl ester Formula: C22H24N4O3 MolecularWeight: 392.45096

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)CC(C1=CC=CC=C1)NC(=O)C2=CC=C(C=C2)CN3C=NC=N3

Isomeric SMILES

CC(C)OC(=O)CC(C1=CC=CC=C1)NC(=O)C2=CC=C(C=C2)CN3C=NC=N3

InChI

InChI=1S/C22H24N4O3/c1-16(2)29-21(27)12-20(18-6-4-3-5-7-18)25-22(28)19-10-8-17(9-11-19)13-26-15-23-14-24-26/h3-11,14-16,20H,12-13H2,1-2H3,(H,25,28)