methyl 2-[[[2-[(3-fluorophenyl)amino]-2-oxidanylidene-ethyl]-methyl-amino]methyl]-4-oxidanylidene-1H-quinazoline-7-carboxylate

Systemtic Name: methyl 2-[[[2-[(3-fluorophenyl)amino]-2-oxidanylidene-ethyl]-methyl-amino]methyl]-4-oxidanylidene-1H-quinazoline-7-carboxylate Openeye Name: methyl 2-[[[2-(3-fluoroanilino)-2-oxo-ethyl]-methyl-amino]methyl]-4-oxo-1H-quinazoline-7-carboxylate CAS Name: 2-[[[2-(3-fluoroanilino)-2-oxoethyl]-methylamino]methyl]-4-oxo-1H-quinazoline-7-carboxylic acid methyl ester IUPAC Name: methyl 2-[[[2-(3-fluoroanilino)-2-oxoethyl]-methylamino]methyl]-4-oxo-1H-quinazoline-7-carboxylate Traditional Name: 2-[[[2-(3-fluoroanilino)-2-keto-ethyl]-methyl-amino]methyl]-4-keto-1H-quinazoline-7-carboxylic acid methyl ester Formula: C20H19FN4O4 MolecularWeight: 398.387663

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=NC(=O)C2=C(N1)C=C(C=C2)C(=O)OC)CC(=O)NC3=CC(=CC=C3)F

Isomeric SMILES

CN(CC1=NC(=O)C2=C(N1)C=C(C=C2)C(=O)OC)CC(=O)NC3=CC(=CC=C3)F

InChI

InChI=1S/C20H19FN4O4/c1-25(11-18(26)22-14-5-3-4-13(21)9-14)10-17-23-16-8-12(20(28)29-2)6-7-15(16)19(27)24-17/h3-9H,10-11H2,1-2H3,(H,22,26)(H,23,24,27)