N-methoxy-4-methyl-3-[4-oxidanylidene-6-[(3-oxidanylidenepiperazin-1-yl)methyl]quinazolin-3-yl]benzamide

Systemtic Name: N-methoxy-4-methyl-3-[4-oxidanylidene-6-[(3-oxidanylidenepiperazin-1-yl)methyl]quinazolin-3-yl]benzamide Openeye Name: N-methoxy-4-methyl-3-[4-oxo-6-[(3-oxopiperazin-1-yl)methyl]quinazolin-3-yl]benzamide CAS Name: N-methoxy-4-methyl-3-[4-oxo-6-[(3-oxo-1-piperazinyl)methyl]-3-quinazolinyl]benzamide IUPAC Name: N-methoxy-4-methyl-3-[4-oxo-6-[(3-oxopiperazin-1-yl)methyl]quinazolin-3-yl]benzamide Traditional Name: 3-[4-keto-6-[(3-ketopiperazino)methyl]quinazolin-3-yl]-N-methoxy-4-methyl-benzamide Formula: C22H23N5O4 MolecularWeight: 421.44912

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NOC)N2C=NC3=C(C2=O)C=C(C=C3)CN4CCNC(=O)C4

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NOC)N2C=NC3=C(C2=O)C=C(C=C3)CN4CCNC(=O)C4

InChI

InChI=1S/C22H23N5O4/c1-14-3-5-16(21(29)25-31-2)10-19(14)27-13-24-18-6-4-15(9-17(18)22(27)30)11-26-8-7-23-20(28)12-26/h3-6,9-10,13H,7-8,11-12H2,1-2H3,(H,23,28)(H,25,29)