1-methyl-4-[[1-methyl-4-[(2-methylpropan-2-yl)oxycarbonylamino]pyrrol-2-yl]carbonylamino]imidazole-2-carboxylic acid

Systemtic Name: 1-methyl-4-[[1-methyl-4-[(2-methylpropan-2-yl)oxycarbonylamino]pyrrol-2-yl]carbonylamino]imidazole-2-carboxylic acid Openeye Name: 4-[[4-(tert-butoxycarbonylamino)-1-methyl-pyrrole-2-carbonyl]amino]-1-methyl-imidazole-2-carboxylic acid CAS Name: 1-methyl-4-[[[1-methyl-4-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-2-pyrrolyl]-oxomethyl]amino]-2-imidazolecarboxylic acid IUPAC Name: 1-methyl-4-[[1-methyl-4-[(2-methylpropan-2-yl)oxycarbonylamino]pyrrole-2-carbonyl]amino]imidazole-2-carboxylic acid Traditional Name: 4-[[4-(tert-butoxycarbonylamino)-1-methyl-pyrrole-2-carbonyl]amino]-1-methyl-imidazole-2-carboxylic acid Formula: C16H21N5O5 MolecularWeight: 363.36844

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC1=CN(C(=C1)C(=O)NC2=CN(C(=N2)C(=O)O)C)C

Isomeric SMILES

CC(C)(C)OC(=O)NC1=CN(C(=C1)C(=O)NC2=CN(C(=N2)C(=O)O)C)C

InChI

InChI=1S/C16H21N5O5/c1-16(2,3)26-15(25)17-9-6-10(20(4)7-9)13(22)19-11-8-21(5)12(18-11)14(23)24/h6-8H,1-5H3,(H,17,25)(H,19,22)(H,23,24)