2-[5-chloranyl-3-[2-[(2-methylpropan-2-yl)oxycarbonylamino]ethylamino]-2-oxidanylidene-6-phenyl-pyrazin-1-yl]ethanoic acid

Systemtic Name: 2-[5-chloranyl-3-[2-[(2-methylpropan-2-yl)oxycarbonylamino]ethylamino]-2-oxidanylidene-6-phenyl-pyrazin-1-yl]ethanoic acid Openeye Name: 2-[3-[2-(tert-butoxycarbonylamino)ethylamino]-5-chloro-2-oxo-6-phenyl-pyrazin-1-yl]acetic acid CAS Name: 2-[5-chloro-3-[2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]ethylamino]-2-oxo-6-phenyl-1-pyrazinyl]acetic acid IUPAC Name: 2-[5-chloro-3-[2-[(2-methylpropan-2-yl)oxycarbonylamino]ethylamino]-2-oxo-6-phenylpyrazin-1-yl]acetic acid Traditional Name: 2-[3-[2-(tert-butoxycarbonylamino)ethylamino]-5-chloro-2-keto-6-phenyl-pyrazin-1-yl]acetic acid Formula: C19H23ClN4O5 MolecularWeight: 422.86272

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NCCNC1=NC(=C(N(C1=O)CC(=O)O)C2=CC=CC=C2)Cl

Isomeric SMILES

CC(C)(C)OC(=O)NCCNC1=NC(=C(N(C1=O)CC(=O)O)C2=CC=CC=C2)Cl

InChI

InChI=1S/C19H23ClN4O5/c1-19(2,3)29-18(28)22-10-9-21-16-17(27)24(11-13(25)26)14(15(20)23-16)12-7-5-4-6-8-12/h4-8H,9-11H2,1-3H3,(H,21,23)(H,22,28)(H,25,26)