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

Systemtic Name: N-cyclopropyl-3-[6-[4-(2-hydroxyethyl)piperazin-1-yl]-4-oxidanylidene-quinazolin-3-yl]-4-methyl-benzamide Openeye Name: N-cyclopropyl-3-[6-[4-(2-hydroxyethyl)piperazin-1-yl]-4-oxo-quinazolin-3-yl]-4-methyl-benzamide CAS Name: N-cyclopropyl-3-[6-[4-(2-hydroxyethyl)-1-piperazinyl]-4-oxo-3-quinazolinyl]-4-methylbenzamide IUPAC Name: N-cyclopropyl-3-[6-[4-(2-hydroxyethyl)piperazin-1-yl]-4-oxoquinazolin-3-yl]-4-methylbenzamide Traditional Name: N-cyclopropyl-3-[6-[4-(2-hydroxyethyl)piperazino]-4-keto-quinazolin-3-yl]-4-methyl-benzamide Formula: C25H29N5O3 MolecularWeight: 447.52946

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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)CCO

Isomeric SMILES

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

InChI

InChI=1S/C25H29N5O3/c1-17-2-3-18(24(32)27-19-4-5-19)14-23(17)30-16-26-22-7-6-20(15-21(22)25(30)33)29-10-8-28(9-11-29)12-13-31/h2-3,6-7,14-16,19,31H,4-5,8-13H2,1H3,(H,27,32)