tert-butyl N-[(2S)-1-(1H-benzimidazol-2-ylmethylamino)-3-methyl-1-oxidanylidene-pentan-2-yl]carbamate

Systemtic Name: tert-butyl N-[(2S)-1-(1H-benzimidazol-2-ylmethylamino)-3-methyl-1-oxidanylidene-pentan-2-yl]carbamate Openeye Name: tert-butyl N-[(1S)-1-(1H-benzimidazol-2-ylmethylcarbamoyl)-2-methyl-butyl]carbamate CAS Name: N-[(2S)-1-(1H-benzimidazol-2-ylmethylamino)-3-methyl-1-oxopentan-2-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[(2S)-1-(1H-benzimidazol-2-ylmethylamino)-3-methyl-1-oxopentan-2-yl]carbamate Traditional Name: N-[(1S)-1-(1H-benzimidazol-2-ylmethylcarbamoyl)-2-methyl-butyl]carbamic acid tert-butyl ester Formula: C19H28N4O3 MolecularWeight: 360.45062

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)NCC1=NC2=CC=CC=C2N1)NC(=O)OC(C)(C)C

Isomeric SMILES

CCC(C)[C@@H](C(=O)NCC1=NC2=CC=CC=C2N1)NC(=O)OC(C)(C)C

InChI

InChI=1S/C19H28N4O3/c1-6-12(2)16(23-18(25)26-19(3,4)5)17(24)20-11-15-21-13-9-7-8-10-14(13)22-15/h7-10,12,16H,6,11H2,1-5H3,(H,20,24)(H,21,22)(H,23,25)/t12?,16-/m0/s1