(phenylmethyl) N-[(2S)-1-[(6-morpholin-4-ylpyridin-3-yl)methylamino]-1-oxidanylidene-propan-2-yl]carbamate

Systemtic Name: (phenylmethyl) N-[(2S)-1-[(6-morpholin-4-ylpyridin-3-yl)methylamino]-1-oxidanylidene-propan-2-yl]carbamate Openeye Name: benzyl N-[(1S)-1-methyl-2-[(6-morpholino-3-pyridyl)methylamino]-2-oxo-ethyl]carbamate CAS Name: N-[(2S)-1-[[6-(4-morpholinyl)-3-pyridinyl]methylamino]-1-oxopropan-2-yl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[(2S)-1-[(6-morpholin-4-ylpyridin-3-yl)methylamino]-1-oxopropan-2-yl]carbamate Traditional Name: N-[(1S)-2-keto-1-methyl-2-[(6-morpholino-3-pyridyl)methylamino]ethyl]carbamic acid benzyl ester Formula: C21H26N4O4 MolecularWeight: 398.45554

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC1=CN=C(C=C1)N2CCOCC2)NC(=O)OCC3=CC=CC=C3

Isomeric SMILES

C[C@@H](C(=O)NCC1=CN=C(C=C1)N2CCOCC2)NC(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C21H26N4O4/c1-16(24-21(27)29-15-17-5-3-2-4-6-17)20(26)23-14-18-7-8-19(22-13-18)25-9-11-28-12-10-25/h2-8,13,16H,9-12,14-15H2,1H3,(H,23,26)(H,24,27)/t16-/m0/s1