tert-butyl N-[[(2S)-4-methyl-2-[(2-methyl-3-oxidanyl-phenyl)carbonylamino]pentanoyl]-phenyl-amino]carbamate

Systemtic Name: tert-butyl N-[[(2S)-4-methyl-2-[(2-methyl-3-oxidanyl-phenyl)carbonylamino]pentanoyl]-phenyl-amino]carbamate Openeye Name: tert-butyl N-(N-[(2S)-2-[(3-hydroxy-2-methyl-benzoyl)amino]-4-methyl-pentanoyl]anilino)carbamate CAS Name: N-(N-[(2S)-2-[[(3-hydroxy-2-methylphenyl)-oxomethyl]amino]-4-methyl-1-oxopentyl]anilino)carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-(N-[(2S)-2-[(3-hydroxy-2-methylbenzoyl)amino]-4-methylpentanoyl]anilino)carbamate Traditional Name: N-(N-[(2S)-2-[(3-hydroxy-2-methyl-benzoyl)amino]-4-methyl-pentanoyl]anilino)carbamic acid tert-butyl ester Formula: C25H33N3O5 MolecularWeight: 455.54662

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1O)C(=O)NC(CC(C)C)C(=O)N(C2=CC=CC=C2)NC(=O)OC(C)(C)C

Isomeric SMILES

CC1=C(C=CC=C1O)C(=O)N[C@@H](CC(C)C)C(=O)N(C2=CC=CC=C2)NC(=O)OC(C)(C)C

InChI

InChI=1S/C25H33N3O5/c1-16(2)15-20(26-22(30)19-13-10-14-21(29)17(19)3)23(31)28(18-11-8-7-9-12-18)27-24(32)33-25(4,5)6/h7-14,16,20,29H,15H2,1-6H3,(H,26,30)(H,27,32)/t20-/m0/s1