[4-[(4-azanylquinazolin-2-yl)methyl]piperazin-1-yl]-(3-methoxy-4-methyl-phenyl)methanone

Systemtic Name: [4-[(4-azanylquinazolin-2-yl)methyl]piperazin-1-yl]-(3-methoxy-4-methyl-phenyl)methanone Openeye Name: [4-[(4-aminoquinazolin-2-yl)methyl]piperazin-1-yl]-(3-methoxy-4-methyl-phenyl)methanone CAS Name: [4-[(4-amino-2-quinazolinyl)methyl]-1-piperazinyl]-(3-methoxy-4-methylphenyl)methanone IUPAC Name: [4-[(4-aminoquinazolin-2-yl)methyl]piperazin-1-yl]-(3-methoxy-4-methylphenyl)methanone Traditional Name: [4-[(4-aminoquinazolin-2-yl)methyl]piperazino]-(3-methoxy-4-methyl-phenyl)methanone Formula: C22H25N5O2 MolecularWeight: 391.4662

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)N2CCN(CC2)CC3=NC4=CC=CC=C4C(=N3)N)OC

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)N2CCN(CC2)CC3=NC4=CC=CC=C4C(=N3)N)OC

InChI

InChI=1S/C22H25N5O2/c1-15-7-8-16(13-19(15)29-2)22(28)27-11-9-26(10-12-27)14-20-24-18-6-4-3-5-17(18)21(23)25-20/h3-8,13H,9-12,14H2,1-2H3,(H2,23,24,25)