N-[(1S,2R)-3-[(2-azanyl-3H-benzimidazol-5-yl)amino]-2-oxidanyl-3-oxidanylidene-1-phenyl-propyl]-4-tert-butyl-benzamide

Systemtic Name: N-[(1S,2R)-3-[(2-azanyl-3H-benzimidazol-5-yl)amino]-2-oxidanyl-3-oxidanylidene-1-phenyl-propyl]-4-tert-butyl-benzamide Openeye Name: N-[(1S,2R)-3-[(2-amino-3H-benzimidazol-5-yl)amino]-2-hydroxy-3-oxo-1-phenyl-propyl]-4-tert-butyl-benzamide CAS Name: N-[(1S,2R)-3-[(2-amino-3H-benzimidazol-5-yl)amino]-2-hydroxy-3-oxo-1-phenylpropyl]-4-tert-butylbenzamide IUPAC Name: N-[(1S,2R)-3-[(2-amino-3H-benzimidazol-5-yl)amino]-2-hydroxy-3-oxo-1-phenylpropyl]-4-tert-butylbenzamide Traditional Name: N-[(1S,2R)-3-[(2-amino-3H-benzimidazol-5-yl)amino]-2-hydroxy-3-keto-1-phenyl-propyl]-4-tert-butyl-benzamide Formula: C27H29N5O3 MolecularWeight: 471.55086

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)NC(C2=CC=CC=C2)C(C(=O)NC3=CC4=C(C=C3)N=C(N4)N)O

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)N[C@@H](C2=CC=CC=C2)[C@H](C(=O)NC3=CC4=C(C=C3)N=C(N4)N)O

InChI

InChI=1S/C27H29N5O3/c1-27(2,3)18-11-9-17(10-12-18)24(34)32-22(16-7-5-4-6-8-16)23(33)25(35)29-19-13-14-20-21(15-19)31-26(28)30-20/h4-15,22-23,33H,1-3H3,(H,29,35)(H,32,34)(H3,28,30,31)/t22-,23+/m0/s1