methyl (4S)-4-(1-methyl-4-methylsulfanyl-imidazol-2-yl)-4-[(2-methylpropan-2-yl)oxycarbonylamino]butanoate

Systemtic Name: methyl (4S)-4-(1-methyl-4-methylsulfanyl-imidazol-2-yl)-4-[(2-methylpropan-2-yl)oxycarbonylamino]butanoate Openeye Name: methyl (4S)-4-(tert-butoxycarbonylamino)-4-(1-methyl-4-methylsulfanyl-imidazol-2-yl)butanoate CAS Name: (4S)-4-[1-methyl-4-(methylthio)-2-imidazolyl]-4-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]butanoic acid methyl ester IUPAC Name: methyl (4S)-4-(1-methyl-4-methylsulfanylimidazol-2-yl)-4-[(2-methylpropan-2-yl)oxycarbonylamino]butanoate Traditional Name: (4S)-4-(tert-butoxycarbonylamino)-4-[1-methyl-4-(methylthio)imidazol-2-yl]butyric acid methyl ester Formula: C15H25N3O4S MolecularWeight: 343.4417

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CCC(=O)OC)C1=NC(=CN1C)SC

Isomeric SMILES

CC(C)(C)OC(=O)N[C@@H](CCC(=O)OC)C1=NC(=CN1C)SC

InChI

InChI=1S/C15H25N3O4S/c1-15(2,3)22-14(20)16-10(7-8-12(19)21-5)13-17-11(23-6)9-18(13)4/h9-10H,7-8H2,1-6H3,(H,16,20)/t10-/m0/s1