(phenylmethyl) N-[1-[[(E)-1-acetamido-3-azanyl-3-oxidanylidene-prop-1-en-2-yl]amino]-3-cyclohexyl-1-oxidanylidene-propan-2-yl]carbamate

Systemtic Name: (phenylmethyl) N-[1-[[(E)-1-acetamido-3-azanyl-3-oxidanylidene-prop-1-en-2-yl]amino]-3-cyclohexyl-1-oxidanylidene-propan-2-yl]carbamate Openeye Name: benzyl N-[2-[[(E)-2-acetamido-1-carbamoyl-vinyl]amino]-1-(cyclohexylmethyl)-2-oxo-ethyl]carbamate CAS Name: N-[1-[[(E)-1-acetamido-3-amino-3-oxoprop-1-en-2-yl]amino]-3-cyclohexyl-1-oxopropan-2-yl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[1-[[(E)-1-acetamido-3-amino-3-oxoprop-1-en-2-yl]amino]-3-cyclohexyl-1-oxopropan-2-yl]carbamate Traditional Name: N-[2-[[(E)-2-acetamido-1-carbamoyl-vinyl]amino]-1-(cyclohexylmethyl)-2-keto-ethyl]carbamic acid benzyl ester Formula: C22H30N4O5 MolecularWeight: 430.4974

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC=C(C(=O)N)NC(=O)C(CC1CCCCC1)NC(=O)OCC2=CC=CC=C2

Isomeric SMILES

CC(=O)N/C=C(\C(=O)N)/NC(=O)C(CC1CCCCC1)NC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C22H30N4O5/c1-15(27)24-13-19(20(23)28)25-21(29)18(12-16-8-4-2-5-9-16)26-22(30)31-14-17-10-6-3-7-11-17/h3,6-7,10-11,13,16,18H,2,4-5,8-9,12,14H2,1H3,(H2,23,28)(H,24,27)(H,25,29)(H,26,30)/b19-13+