2-[[2-[(2-acetamido-5-azanyl-pentanoyl)amino]-3-phenyl-propanoyl]amino]-4-methyl-pentanamide

Systemtic Name: 2-[[2-[(2-acetamido-5-azanyl-pentanoyl)amino]-3-phenyl-propanoyl]amino]-4-methyl-pentanamide Openeye Name: 2-[[2-[(2-acetamido-5-amino-pentanoyl)amino]-3-phenyl-propanoyl]amino]-4-methyl-pentanamide CAS Name: 2-[[2-[(2-acetamido-5-amino-1-oxopentyl)amino]-1-oxo-3-phenylpropyl]amino]-4-methylpentanamide IUPAC Name: 2-[[2-[(2-acetamido-5-aminopentanoyl)amino]-3-phenylpropanoyl]amino]-4-methylpentanamide Traditional Name: 2-[[2-[(2-acetamido-5-amino-pentanoyl)amino]-3-phenyl-propanoyl]amino]-4-methyl-valeramide Formula: C22H35N5O4 MolecularWeight: 433.5444

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)N)NC(=O)C(CC1=CC=CC=C1)NC(=O)C(CCCN)NC(=O)C

Isomeric SMILES

CC(C)CC(C(=O)N)NC(=O)C(CC1=CC=CC=C1)NC(=O)C(CCCN)NC(=O)C

InChI

InChI=1S/C22H35N5O4/c1-14(2)12-18(20(24)29)26-22(31)19(13-16-8-5-4-6-9-16)27-21(30)17(10-7-11-23)25-15(3)28/h4-6,8-9,14,17-19H,7,10-13,23H2,1-3H3,(H2,24,29)(H,25,28)(H,26,31)(H,27,30)