tert-butyl N-[(2S,3S,5R)-5-[5-(2,2-dimethylbut-3-enoyl)-1H-imidazol-2-yl]-3-oxidanyl-1,6-diphenyl-hexan-2-yl]carbamate

Systemtic Name: tert-butyl N-[(2S,3S,5R)-5-[5-(2,2-dimethylbut-3-enoyl)-1H-imidazol-2-yl]-3-oxidanyl-1,6-diphenyl-hexan-2-yl]carbamate Openeye Name: tert-butyl N-[(1S,2S,4R)-1-benzyl-4-[5-(2,2-dimethylbut-3-enoyl)-1H-imidazol-2-yl]-2-hydroxy-5-phenyl-pentyl]carbamate CAS Name: N-[(2S,3S,5R)-5-[5-(2,2-dimethyl-1-oxobut-3-enyl)-1H-imidazol-2-yl]-3-hydroxy-1,6-diphenylhexan-2-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[(2S,3S,5R)-5-[5-(2,2-dimethylbut-3-enoyl)-1H-imidazol-2-yl]-3-hydroxy-1,6-diphenylhexan-2-yl]carbamate Traditional Name: N-[(1S,2S,4R)-1-benzyl-4-[5-(2,2-dimethylbut-3-enoyl)-1H-imidazol-2-yl]-2-hydroxy-5-phenyl-pentyl]carbamic acid tert-butyl ester Formula: C32H41N3O4 MolecularWeight: 531.68564

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CC1=CC=CC=C1)C(CC(CC2=CC=CC=C2)C3=NC=C(N3)C(=O)C(C)(C)C=C)O

Isomeric SMILES

CC(C)(C)OC(=O)N[C@@H](CC1=CC=CC=C1)[C@H](C[C@@H](CC2=CC=CC=C2)C3=NC=C(N3)C(=O)C(C)(C)C=C)O

InChI

InChI=1S/C32H41N3O4/c1-7-32(5,6)28(37)26-21-33-29(34-26)24(18-22-14-10-8-11-15-22)20-27(36)25(19-23-16-12-9-13-17-23)35-30(38)39-31(2,3)4/h7-17,21,24-25,27,36H,1,18-20H2,2-6H3,(H,33,34)(H,35,38)/t24-,25+,27+/m1/s1