ethyl 2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-[4-[(5-methylquinazolin-4-yl)amino]phenyl]propanoate

Systemtic Name: ethyl 2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-[4-[(5-methylquinazolin-4-yl)amino]phenyl]propanoate Openeye Name: ethyl 2-(tert-butoxycarbonylamino)-3-[4-[(5-methylquinazolin-4-yl)amino]phenyl]propanoate CAS Name: 2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-3-[4-[(5-methyl-4-quinazolinyl)amino]phenyl]propanoic acid ethyl ester IUPAC Name: ethyl 2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-[4-[(5-methylquinazolin-4-yl)amino]phenyl]propanoate Traditional Name: 2-(tert-butoxycarbonylamino)-3-[4-[(5-methylquinazolin-4-yl)amino]phenyl]propionic acid ethyl ester Formula: C25H30N4O4 MolecularWeight: 450.5301

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC1=CC=C(C=C1)NC2=NC=NC3=CC=CC(=C32)C)NC(=O)OC(C)(C)C

Isomeric SMILES

CCOC(=O)C(CC1=CC=C(C=C1)NC2=NC=NC3=CC=CC(=C32)C)NC(=O)OC(C)(C)C

InChI

InChI=1S/C25H30N4O4/c1-6-32-23(30)20(29-24(31)33-25(3,4)5)14-17-10-12-18(13-11-17)28-22-21-16(2)8-7-9-19(21)26-15-27-22/h7-13,15,20H,6,14H2,1-5H3,(H,29,31)(H,26,27,28)