(2S)-2-azanyl-N-[(2S,3R)-4-(tert-butylcarbamoylamino)-7-methyl-3-oxidanyl-1-phenyl-octan-2-yl]butanediamide

Systemtic Name: (2S)-2-azanyl-N-[(2S,3R)-4-(tert-butylcarbamoylamino)-7-methyl-3-oxidanyl-1-phenyl-octan-2-yl]butanediamide Openeye Name: (2S)-2-amino-N-[(1S,2R)-1-benzyl-3-(tert-butylcarbamoylamino)-2-hydroxy-6-methyl-heptyl]butanediamide CAS Name: (2S)-2-amino-N-[(2S,3R)-4-[[(tert-butylamino)-oxomethyl]amino]-3-hydroxy-7-methyl-1-phenyloctan-2-yl]butanediamide IUPAC Name: (2S)-2-amino-N-[(2S,3R)-4-(tert-butylcarbamoylamino)-3-hydroxy-7-methyl-1-phenyloctan-2-yl]butanediamide Traditional Name: (2S)-2-amino-N-[(1S,2R)-1-benzyl-3-(tert-butylcarbamoylamino)-2-hydroxy-6-methyl-heptyl]succinamide Formula: C24H41N5O4 MolecularWeight: 463.61344

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC(C)CCC([C@@H]([C@H](CC1=CC=CC=C1)NC(=O)[C@H](CC(=O)N)N)O)NC(=O)NC(C)(C)C

InChI

InChI=1S/C24H41N5O4/c1-15(2)11-12-18(28-23(33)29-24(3,4)5)21(31)19(13-16-9-7-6-8-10-16)27-22(32)17(25)14-20(26)30/h6-10,15,17-19,21,31H,11-14,25H2,1-5H3,(H2,26,30)(H,27,32)(H2,28,29,33)/t17-,18?,19-,21-/m0/s1