N-tert-butyl-2-[(4-chlorophenyl)carbonyl-(4-fluorophenyl)amino]-3-ethyl-4H-quinazoline-4-carboxamide

Systemtic Name: N-tert-butyl-2-[(4-chlorophenyl)carbonyl-(4-fluorophenyl)amino]-3-ethyl-4H-quinazoline-4-carboxamide Openeye Name: N-tert-butyl-2-(N-(4-chlorobenzoyl)-4-fluoro-anilino)-3-ethyl-4H-quinazoline-4-carboxamide CAS Name: N-tert-butyl-2-(N-[(4-chlorophenyl)-oxomethyl]-4-fluoroanilino)-3-ethyl-4H-quinazoline-4-carboxamide IUPAC Name: N-tert-butyl-2-(N-(4-chlorobenzoyl)-4-fluoroanilino)-3-ethyl-4H-quinazoline-4-carboxamide Traditional Name: N-tert-butyl-2-(N-(4-chlorobenzoyl)-4-fluoro-anilino)-3-ethyl-4H-quinazoline-4-carboxamide Formula: C28H28ClFN4O2 MolecularWeight: 506.998923

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(C2=CC=CC=C2N=C1N(C3=CC=C(C=C3)F)C(=O)C4=CC=C(C=C4)Cl)C(=O)NC(C)(C)C

Isomeric SMILES

CCN1C(C2=CC=CC=C2N=C1N(C3=CC=C(C=C3)F)C(=O)C4=CC=C(C=C4)Cl)C(=O)NC(C)(C)C

InChI

InChI=1S/C28H28ClFN4O2/c1-5-33-24(25(35)32-28(2,3)4)22-8-6-7-9-23(22)31-27(33)34(21-16-14-20(30)15-17-21)26(36)18-10-12-19(29)13-11-18/h6-17,24H,5H2,1-4H3,(H,32,35)