N-[(2S,3R)-5-[[2-(tert-butylamino)-2-oxidanylidene-ethyl]amino]-3-oxidanyl-1-phenyl-pentan-2-yl]-2-methyl-3-oxidanyl-benzamide

Systemtic Name: N-[(2S,3R)-5-[[2-(tert-butylamino)-2-oxidanylidene-ethyl]amino]-3-oxidanyl-1-phenyl-pentan-2-yl]-2-methyl-3-oxidanyl-benzamide Openeye Name: N-[(1S,2R)-1-benzyl-4-[[2-(tert-butylamino)-2-oxo-ethyl]amino]-2-hydroxy-butyl]-3-hydroxy-2-methyl-benzamide CAS Name: N-[(2S,3R)-5-[[2-(tert-butylamino)-2-oxoethyl]amino]-3-hydroxy-1-phenylpentan-2-yl]-3-hydroxy-2-methylbenzamide IUPAC Name: N-[(2S,3R)-5-[[2-(tert-butylamino)-2-oxoethyl]amino]-3-hydroxy-1-phenylpentan-2-yl]-3-hydroxy-2-methylbenzamide Traditional Name: N-[(1S,2R)-1-benzyl-4-[[2-(tert-butylamino)-2-keto-ethyl]amino]-2-hydroxy-butyl]-3-hydroxy-2-methyl-benzamide Formula: C25H35N3O4 MolecularWeight: 441.5631

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1O)C(=O)NC(CC2=CC=CC=C2)C(CCNCC(=O)NC(C)(C)C)O

Isomeric SMILES

CC1=C(C=CC=C1O)C(=O)N[C@@H](CC2=CC=CC=C2)[C@@H](CCNCC(=O)NC(C)(C)C)O

InChI

InChI=1S/C25H35N3O4/c1-17-19(11-8-12-21(17)29)24(32)27-20(15-18-9-6-5-7-10-18)22(30)13-14-26-16-23(31)28-25(2,3)4/h5-12,20,22,26,29-30H,13-16H2,1-4H3,(H,27,32)(H,28,31)/t20-,22+/m0/s1