tert-butyl (2S)-2-[[4-[(4-methoxyphenyl)carbamoyl]-1H-imidazol-5-yl]carbonylamino]-4-methyl-pentanoate

Systemtic Name: tert-butyl (2S)-2-[[4-[(4-methoxyphenyl)carbamoyl]-1H-imidazol-5-yl]carbonylamino]-4-methyl-pentanoate Openeye Name: tert-butyl (2S)-2-[[4-[(4-methoxyphenyl)carbamoyl]-1H-imidazole-5-carbonyl]amino]-4-methyl-pentanoate CAS Name: (2S)-2-[[[4-[(4-methoxyanilino)-oxomethyl]-1H-imidazol-5-yl]-oxomethyl]amino]-4-methylpentanoic acid tert-butyl ester IUPAC Name: tert-butyl (2S)-2-[[4-[(4-methoxyphenyl)carbamoyl]-1H-imidazole-5-carbonyl]amino]-4-methylpentanoate Traditional Name: (2S)-2-[[4-[(4-methoxyphenyl)carbamoyl]-1H-imidazole-5-carbonyl]amino]-4-methyl-valeric acid tert-butyl ester Formula: C22H30N4O5 MolecularWeight: 430.4974

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)OC(C)(C)C)NC(=O)C1=C(N=CN1)C(=O)NC2=CC=C(C=C2)OC

Isomeric SMILES

CC(C)C[C@@H](C(=O)OC(C)(C)C)NC(=O)C1=C(N=CN1)C(=O)NC2=CC=C(C=C2)OC

InChI

InChI=1S/C22H30N4O5/c1-13(2)11-16(21(29)31-22(3,4)5)26-20(28)18-17(23-12-24-18)19(27)25-14-7-9-15(30-6)10-8-14/h7-10,12-13,16H,11H2,1-6H3,(H,23,24)(H,25,27)(H,26,28)/t16-/m0/s1