5-[[1H-imidazol-2-ylmethyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]methyl]thiophene-2-carboxylic acid

Systemtic Name: 5-[[1H-imidazol-2-ylmethyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]methyl]thiophene-2-carboxylic acid Openeye Name: 5-[[tert-butoxycarbonyl(1H-imidazol-2-ylmethyl)amino]methyl]thiophene-2-carboxylic acid CAS Name: 5-[[1H-imidazol-2-ylmethyl-[(2-methylpropan-2-yl)oxy-oxomethyl]amino]methyl]-2-thiophenecarboxylic acid IUPAC Name: 5-[[1H-imidazol-2-ylmethyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]methyl]thiophene-2-carboxylic acid Traditional Name: 5-[[tert-butoxycarbonyl(1H-imidazol-2-ylmethyl)amino]methyl]-2-thenoic acid Formula: C15H19N3O4S MolecularWeight: 337.39406

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N(CC1=CC=C(S1)C(=O)O)CC2=NC=CN2

Isomeric SMILES

CC(C)(C)OC(=O)N(CC1=CC=C(S1)C(=O)O)CC2=NC=CN2

InChI

InChI=1S/C15H19N3O4S/c1-15(2,3)22-14(21)18(9-12-16-6-7-17-12)8-10-4-5-11(23-10)13(19)20/h4-7H,8-9H2,1-3H3,(H,16,17)(H,19,20)