1-[3-methylpentanoyl-[(3S)-1-oxidanyl-2-oxidanylidene-5-phenyl-pentan-3-yl]amino]-3-(phenylmethyl)urea

Systemtic Name: 1-[3-methylpentanoyl-[(3S)-1-oxidanyl-2-oxidanylidene-5-phenyl-pentan-3-yl]amino]-3-(phenylmethyl)urea Openeye Name: 1-benzyl-3-[[(1S)-3-hydroxy-2-oxo-1-phenethyl-propyl]-(3-methylpentanoyl)amino]urea CAS Name: 1-[[(3S)-1-hydroxy-2-oxo-5-phenylpentan-3-yl]-(3-methyl-1-oxopentyl)amino]-3-(phenylmethyl)urea IUPAC Name: 1-benzyl-3-[[(3S)-1-hydroxy-2-oxo-5-phenylpentan-3-yl]-(3-methylpentanoyl)amino]urea Traditional Name: 1-benzyl-3-[[(1S)-3-hydroxy-2-keto-1-phenethyl-propyl]-(3-methylpentanoyl)amino]urea Formula: C25H33N3O4 MolecularWeight: 439.54722

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)CC(=O)N(C(CCC1=CC=CC=C1)C(=O)CO)NC(=O)NCC2=CC=CC=C2

Isomeric SMILES

CCC(C)CC(=O)N([C@@H](CCC1=CC=CC=C1)C(=O)CO)NC(=O)NCC2=CC=CC=C2

InChI

InChI=1S/C25H33N3O4/c1-3-19(2)16-24(31)28(27-25(32)26-17-21-12-8-5-9-13-21)22(23(30)18-29)15-14-20-10-6-4-7-11-20/h4-13,19,22,29H,3,14-18H2,1-2H3,(H2,26,27,32)/t19?,22-/m0/s1