(phenylmethyl) N-[3-(1H-imidazol-5-yl)-1-oxidanylidene-1-piperazin-1-yl-propan-2-yl]carbamate

Systemtic Name: (phenylmethyl) N-[3-(1H-imidazol-5-yl)-1-oxidanylidene-1-piperazin-1-yl-propan-2-yl]carbamate Openeye Name: benzyl N-[1-(1H-imidazol-5-ylmethyl)-2-oxo-2-piperazin-1-yl-ethyl]carbamate CAS Name: N-[3-(1H-imidazol-5-yl)-1-oxo-1-(1-piperazinyl)propan-2-yl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[3-(1H-imidazol-5-yl)-1-oxo-1-piperazin-1-ylpropan-2-yl]carbamate Traditional Name: N-[1-(1H-imidazol-5-ylmethyl)-2-keto-2-piperazino-ethyl]carbamic acid benzyl ester Formula: C18H23N5O3 MolecularWeight: 357.40692

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)C(=O)C(CC2=CN=CN2)NC(=O)OCC3=CC=CC=C3

Isomeric SMILES

C1CN(CCN1)C(=O)C(CC2=CN=CN2)NC(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C18H23N5O3/c24-17(23-8-6-19-7-9-23)16(10-15-11-20-13-21-15)22-18(25)26-12-14-4-2-1-3-5-14/h1-5,11,13,16,19H,6-10,12H2,(H,20,21)(H,22,25)