N-(2,4-dimethoxyphenyl)-4-methyl-N-[1-[3-(4-methylpiperazin-1-yl)-4-oxidanylidene-quinazolin-2-yl]ethyl]benzamide

Systemtic Name: N-(2,4-dimethoxyphenyl)-4-methyl-N-[1-[3-(4-methylpiperazin-1-yl)-4-oxidanylidene-quinazolin-2-yl]ethyl]benzamide Openeye Name: N-(2,4-dimethoxyphenyl)-4-methyl-N-[1-[3-(4-methylpiperazin-1-yl)-4-oxo-quinazolin-2-yl]ethyl]benzamide CAS Name: N-(2,4-dimethoxyphenyl)-4-methyl-N-[1-[3-(4-methyl-1-piperazinyl)-4-oxo-2-quinazolinyl]ethyl]benzamide IUPAC Name: N-(2,4-dimethoxyphenyl)-4-methyl-N-[1-[3-(4-methylpiperazin-1-yl)-4-oxoquinazolin-2-yl]ethyl]benzamide Traditional Name: N-(2,4-dimethoxyphenyl)-N-[1-[4-keto-3-(4-methylpiperazino)quinazolin-2-yl]ethyl]-4-methyl-benzamide Formula: C31H35N5O4 MolecularWeight: 541.6407

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)N(C2=C(C=C(C=C2)OC)OC)C(C)C3=NC4=CC=CC=C4C(=O)N3N5CCN(CC5)C

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)N(C2=C(C=C(C=C2)OC)OC)C(C)C3=NC4=CC=CC=C4C(=O)N3N5CCN(CC5)C

InChI

InChI=1S/C31H35N5O4/c1-21-10-12-23(13-11-21)30(37)35(27-15-14-24(39-4)20-28(27)40-5)22(2)29-32-26-9-7-6-8-25(26)31(38)36(29)34-18-16-33(3)17-19-34/h6-15,20,22H,16-19H2,1-5H3