methyl 5-[(2S)-3-oxidanylidene-3-phenylmethoxy-2-(phenylmethoxycarbonylamino)propyl]-1-(6-phenylpyridazin-3-yl)pyrazole-4-carboxylate

Systemtic Name: methyl 5-[(2S)-3-oxidanylidene-3-phenylmethoxy-2-(phenylmethoxycarbonylamino)propyl]-1-(6-phenylpyridazin-3-yl)pyrazole-4-carboxylate Openeye Name: methyl 5-[(2S)-3-benzyloxy-2-(benzyloxycarbonylamino)-3-oxo-propyl]-1-(6-phenylpyridazin-3-yl)pyrazole-4-carboxylate CAS Name: 5-[(2S)-3-oxo-3-phenylmethoxy-2-(phenylmethoxycarbonylamino)propyl]-1-(6-phenyl-3-pyridazinyl)-4-pyrazolecarboxylic acid methyl ester IUPAC Name: methyl 5-[(2S)-3-oxo-3-phenylmethoxy-2-(phenylmethoxycarbonylamino)propyl]-1-(6-phenylpyridazin-3-yl)pyrazole-4-carboxylate Traditional Name: 5-[(2S)-3-benzoxy-2-(benzyloxycarbonylamino)-3-keto-propyl]-1-(6-phenylpyridazin-3-yl)pyrazole-4-carboxylic acid methyl ester Formula: C33H29N5O6 MolecularWeight: 591.61326

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(N(N=C1)C2=NN=C(C=C2)C3=CC=CC=C3)CC(C(=O)OCC4=CC=CC=C4)NC(=O)OCC5=CC=CC=C5

Isomeric SMILES

COC(=O)C1=C(N(N=C1)C2=NN=C(C=C2)C3=CC=CC=C3)C[C@@H](C(=O)OCC4=CC=CC=C4)NC(=O)OCC5=CC=CC=C5

InChI

InChI=1S/C33H29N5O6/c1-42-31(39)26-20-34-38(30-18-17-27(36-37-30)25-15-9-4-10-16-25)29(26)19-28(32(40)43-21-23-11-5-2-6-12-23)35-33(41)44-22-24-13-7-3-8-14-24/h2-18,20,28H,19,21-22H2,1H3,(H,35,41)/t28-/m0/s1