(phenylmethyl) N-[(2S)-1-(benzimidazol-1-ylamino)-1-oxidanylidene-propan-2-yl]carbamate

Systemtic Name: (phenylmethyl) N-[(2S)-1-(benzimidazol-1-ylamino)-1-oxidanylidene-propan-2-yl]carbamate Openeye Name: benzyl N-[(1S)-2-(benzimidazol-1-ylamino)-1-methyl-2-oxo-ethyl]carbamate CAS Name: N-[(2S)-1-(1-benzimidazolylamino)-1-oxopropan-2-yl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[(2S)-1-(benzimidazol-1-ylamino)-1-oxopropan-2-yl]carbamate Traditional Name: N-[(1S)-2-(benzimidazol-1-ylamino)-2-keto-1-methyl-ethyl]carbamic acid benzyl ester Formula: C18H18N4O3 MolecularWeight: 338.36052

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NN1C=NC2=CC=CC=C21)NC(=O)OCC3=CC=CC=C3

Isomeric SMILES

C[C@@H](C(=O)NN1C=NC2=CC=CC=C21)NC(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C18H18N4O3/c1-13(20-18(24)25-11-14-7-3-2-4-8-14)17(23)21-22-12-19-15-9-5-6-10-16(15)22/h2-10,12-13H,11H2,1H3,(H,20,24)(H,21,23)/t13-/m0/s1