methyl 5-[[4-(4-propan-2-ylphenyl)-6-prop-2-ynoxy-quinazolin-2-yl]carbonylamino]pyridine-2-carboxylate

Systemtic Name: methyl 5-[[4-(4-propan-2-ylphenyl)-6-prop-2-ynoxy-quinazolin-2-yl]carbonylamino]pyridine-2-carboxylate Openeye Name: methyl 5-[[4-(4-isopropylphenyl)-6-prop-2-ynoxy-quinazoline-2-carbonyl]amino]pyridine-2-carboxylate CAS Name: 5-[[oxo-[4-(4-propan-2-ylphenyl)-6-prop-2-ynoxy-2-quinazolinyl]methyl]amino]-2-pyridinecarboxylic acid methyl ester IUPAC Name: methyl 5-[[4-(4-propan-2-ylphenyl)-6-prop-2-ynoxyquinazoline-2-carbonyl]amino]pyridine-2-carboxylate Traditional Name: 5-[(4-p-cumenyl-6-propargyloxy-quinazoline-2-carbonyl)amino]picolinic acid methyl ester Formula: C28H24N4O4 MolecularWeight: 480.51456

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C2=NC(=NC3=C2C=C(C=C3)OCC#C)C(=O)NC4=CN=C(C=C4)C(=O)OC

Isomeric SMILES

CC(C)C1=CC=C(C=C1)C2=NC(=NC3=C2C=C(C=C3)OCC#C)C(=O)NC4=CN=C(C=C4)C(=O)OC

InChI

InChI=1S/C28H24N4O4/c1-5-14-36-21-11-13-23-22(15-21)25(19-8-6-18(7-9-19)17(2)3)32-26(31-23)27(33)30-20-10-12-24(29-16-20)28(34)35-4/h1,6-13,15-17H,14H2,2-4H3,(H,30,33)