N-[(2S)-5-[[1-(tert-butylamino)-3-naphthalen-2-yl-1-oxidanylidene-propan-2-yl]-ethanoyl-amino]-3-oxidanyl-1-phenyl-pentan-2-yl]-2-methyl-3-oxidanyl-benzamide

Systemtic Name: N-[(2S)-5-[[1-(tert-butylamino)-3-naphthalen-2-yl-1-oxidanylidene-propan-2-yl]-ethanoyl-amino]-3-oxidanyl-1-phenyl-pentan-2-yl]-2-methyl-3-oxidanyl-benzamide Openeye Name: N-[(1S)-4-[acetyl-[2-(tert-butylamino)-1-(2-naphthylmethyl)-2-oxo-ethyl]amino]-1-benzyl-2-hydroxy-butyl]-3-hydroxy-2-methyl-benzamide CAS Name: N-[(2S)-5-[acetyl-[1-(tert-butylamino)-3-(2-naphthalenyl)-1-oxopropan-2-yl]amino]-3-hydroxy-1-phenylpentan-2-yl]-3-hydroxy-2-methylbenzamide IUPAC Name: N-[(2S)-5-[acetyl-[1-(tert-butylamino)-3-naphthalen-2-yl-1-oxopropan-2-yl]amino]-3-hydroxy-1-phenylpentan-2-yl]-3-hydroxy-2-methylbenzamide Traditional Name: N-[(1S)-4-[acetyl-[2-(tert-butylamino)-2-keto-1-(2-naphthylmethyl)ethyl]amino]-1-benzyl-2-hydroxy-butyl]-3-hydroxy-2-methyl-benzamide Formula: C38H45N3O5 MolecularWeight: 623.781

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1O)C(=O)NC(CC2=CC=CC=C2)C(CCN(C(CC3=CC4=CC=CC=C4C=C3)C(=O)NC(C)(C)C)C(=O)C)O

Isomeric SMILES

CC1=C(C=CC=C1O)C(=O)N[C@@H](CC2=CC=CC=C2)C(CCN(C(CC3=CC4=CC=CC=C4C=C3)C(=O)NC(C)(C)C)C(=O)C)O

InChI

InChI=1S/C38H45N3O5/c1-25-31(16-11-17-34(25)43)36(45)39-32(23-27-12-7-6-8-13-27)35(44)20-21-41(26(2)42)33(37(46)40-38(3,4)5)24-28-18-19-29-14-9-10-15-30(29)22-28/h6-19,22,32-33,35,43-44H,20-21,23-24H2,1-5H3,(H,39,45)(H,40,46)/t32-,33?,35?/m0/s1