(2S)-2-acetamido-N-(phenylmethyl)-6-(prop-2-enylcarbamoylamino)hexanamide

Systemtic Name: (2S)-2-acetamido-N-(phenylmethyl)-6-(prop-2-enylcarbamoylamino)hexanamide Openeye Name: (2S)-2-acetamido-6-(allylcarbamoylamino)-N-benzyl-hexanamide CAS Name: (2S)-2-acetamido-6-[[oxo-(prop-2-enylamino)methyl]amino]-N-(phenylmethyl)hexanamide IUPAC Name: (2S)-2-acetamido-N-benzyl-6-(prop-2-enylcarbamoylamino)hexanamide Traditional Name: (2S)-2-acetamido-6-(allylcarbamoylamino)-N-benzyl-hexanamide Formula: C19H28N4O3 MolecularWeight: 360.45062

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(CCCCNC(=O)NCC=C)C(=O)NCC1=CC=CC=C1

Isomeric SMILES

CC(=O)N[C@@H](CCCCNC(=O)NCC=C)C(=O)NCC1=CC=CC=C1

InChI

InChI=1S/C19H28N4O3/c1-3-12-20-19(26)21-13-8-7-11-17(23-15(2)24)18(25)22-14-16-9-5-4-6-10-16/h3-6,9-10,17H,1,7-8,11-14H2,2H3,(H,22,25)(H,23,24)(H2,20,21,26)/t17-/m0/s1