2-[[(2-acetamido-3-phenyl-propanoyl)amino]carbamoylamino]-N-butyl-3-methyl-butanamide

Systemtic Name: 2-[[(2-acetamido-3-phenyl-propanoyl)amino]carbamoylamino]-N-butyl-3-methyl-butanamide Openeye Name: 2-[[(2-acetamido-3-phenyl-propanoyl)amino]carbamoylamino]-N-butyl-3-methyl-butanamide CAS Name: 2-[[[(2-acetamido-1-oxo-3-phenylpropyl)hydrazo]-oxomethyl]amino]-N-butyl-3-methylbutanamide IUPAC Name: 2-[[(2-acetamido-3-phenylpropanoyl)amino]carbamoylamino]-N-butyl-3-methylbutanamide Traditional Name: 2-[[(2-acetamido-3-phenyl-propanoyl)amino]carbamoylamino]-N-butyl-3-methyl-butyramide Formula: C21H33N5O4 MolecularWeight: 419.51782

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)C(C(C)C)NC(=O)NNC(=O)C(CC1=CC=CC=C1)NC(=O)C

Isomeric SMILES

CCCCNC(=O)C(C(C)C)NC(=O)NNC(=O)C(CC1=CC=CC=C1)NC(=O)C

InChI

InChI=1S/C21H33N5O4/c1-5-6-12-22-20(29)18(14(2)3)24-21(30)26-25-19(28)17(23-15(4)27)13-16-10-8-7-9-11-16/h7-11,14,17-18H,5-6,12-13H2,1-4H3,(H,22,29)(H,23,27)(H,25,28)(H2,24,26,30)