methyl (2S)-2-[[1-(diphenylmethyl)-1,2,3-triazol-4-yl]carbonylamino]-3-methyl-butanoate

Systemtic Name: methyl (2S)-2-[[1-(diphenylmethyl)-1,2,3-triazol-4-yl]carbonylamino]-3-methyl-butanoate Openeye Name: methyl (2S)-2-[(1-benzhydryltriazole-4-carbonyl)amino]-3-methyl-butanoate CAS Name: (2S)-2-[[[1-(diphenylmethyl)-4-triazolyl]-oxomethyl]amino]-3-methylbutanoic acid methyl ester IUPAC Name: methyl (2S)-2-[(1-benzhydryltriazole-4-carbonyl)amino]-3-methylbutanoate Traditional Name: (2S)-2-[(1-benzhydryltriazole-4-carbonyl)amino]-3-methyl-butyric acid methyl ester Formula: C22H24N4O3 MolecularWeight: 392.45096

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)OC)NC(=O)C1=CN(N=N1)C(C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

CC(C)[C@@H](C(=O)OC)NC(=O)C1=CN(N=N1)C(C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C22H24N4O3/c1-15(2)19(22(28)29-3)23-21(27)18-14-26(25-24-18)20(16-10-6-4-7-11-16)17-12-8-5-9-13-17/h4-15,19-20H,1-3H3,(H,23,27)/t19-/m0/s1