2-acetamido-N-[5-azanyl-1-[(1-azanyl-1-oxidanylidene-3-phenyl-propan-2-yl)amino]-1-oxidanylidene-pentan-2-yl]-4-methyl-pentanamide

Systemtic Name: 2-acetamido-N-[5-azanyl-1-[(1-azanyl-1-oxidanylidene-3-phenyl-propan-2-yl)amino]-1-oxidanylidene-pentan-2-yl]-4-methyl-pentanamide Openeye Name: 2-acetamido-N-[4-amino-1-[(2-amino-1-benzyl-2-oxo-ethyl)carbamoyl]butyl]-4-methyl-pentanamide CAS Name: 2-acetamido-N-[5-amino-1-[(1-amino-1-oxo-3-phenylpropan-2-yl)amino]-1-oxopentan-2-yl]-4-methylpentanamide IUPAC Name: 2-acetamido-N-[5-amino-1-[(1-amino-1-oxo-3-phenylpropan-2-yl)amino]-1-oxopentan-2-yl]-4-methylpentanamide Traditional Name: 2-acetamido-N-[4-amino-1-[(2-amino-1-benzyl-2-keto-ethyl)carbamoyl]butyl]-4-methyl-valeramide Formula: C22H35N5O4 MolecularWeight: 433.5444

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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