N-cyclopropyl-3-[6-[4-(2-fluoranylethyl)piperazin-1-yl]-4-oxidanylidene-quinazolin-3-yl]-4-methyl-benzamide

Systemtic Name: N-cyclopropyl-3-[6-[4-(2-fluoranylethyl)piperazin-1-yl]-4-oxidanylidene-quinazolin-3-yl]-4-methyl-benzamide Openeye Name: N-cyclopropyl-3-[6-[4-(2-fluoroethyl)piperazin-1-yl]-4-oxo-quinazolin-3-yl]-4-methyl-benzamide CAS Name: N-cyclopropyl-3-[6-[4-(2-fluoroethyl)-1-piperazinyl]-4-oxo-3-quinazolinyl]-4-methylbenzamide IUPAC Name: N-cyclopropyl-3-[6-[4-(2-fluoroethyl)piperazin-1-yl]-4-oxoquinazolin-3-yl]-4-methylbenzamide Traditional Name: N-cyclopropyl-3-[6-[4-(2-fluoroethyl)piperazino]-4-keto-quinazolin-3-yl]-4-methyl-benzamide Formula: C25H28FN5O2 MolecularWeight: 449.520523

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NC2CC2)N3C=NC4=C(C3=O)C=C(C=C4)N5CCN(CC5)CCF

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NC2CC2)N3C=NC4=C(C3=O)C=C(C=C4)N5CCN(CC5)CCF

InChI

InChI=1S/C25H28FN5O2/c1-17-2-3-18(24(32)28-19-4-5-19)14-23(17)31-16-27-22-7-6-20(15-21(22)25(31)33)30-12-10-29(9-8-26)11-13-30/h2-3,6-7,14-16,19H,4-5,8-13H2,1H3,(H,28,32)