3-(1H-imidazol-5-yl)propyl (2S)-4-(1H-imidazol-5-ylmethyl)-3-oxidanylidene-2-(phenylmethyl)-2H-pyrazine-1-carboxylate

Systemtic Name: 3-(1H-imidazol-5-yl)propyl (2S)-4-(1H-imidazol-5-ylmethyl)-3-oxidanylidene-2-(phenylmethyl)-2H-pyrazine-1-carboxylate Openeye Name: 3-(1H-imidazol-5-yl)propyl (2S)-2-benzyl-4-(1H-imidazol-5-ylmethyl)-3-oxo-2H-pyrazine-1-carboxylate CAS Name: (2S)-4-(1H-imidazol-5-ylmethyl)-3-oxo-2-(phenylmethyl)-2H-pyrazine-1-carboxylic acid 3-(1H-imidazol-5-yl)propyl ester IUPAC Name: 3-(1H-imidazol-5-yl)propyl (2S)-2-benzyl-4-(1H-imidazol-5-ylmethyl)-3-oxo-2H-pyrazine-1-carboxylate Traditional Name: (2S)-2-benzyl-4-(1H-imidazol-5-ylmethyl)-3-keto-2H-pyrazine-1-carboxylic acid 3-(1H-imidazol-5-yl)propyl ester Formula: C22H24N6O3 MolecularWeight: 420.46436

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC2C(=O)N(C=CN2C(=O)OCCCC3=CN=CN3)CC4=CN=CN4

Isomeric SMILES

C1=CC=C(C=C1)C[C@H]2C(=O)N(C=CN2C(=O)OCCCC3=CN=CN3)CC4=CN=CN4

InChI

InChI=1S/C22H24N6O3/c29-21-20(11-17-5-2-1-3-6-17)28(9-8-27(21)14-19-13-24-16-26-19)22(30)31-10-4-7-18-12-23-15-25-18/h1-3,5-6,8-9,12-13,15-16,20H,4,7,10-11,14H2,(H,23,25)(H,24,26)/t20-/m0/s1