2-methyl-3-[2-methyl-5-[(4-phenylpiperazin-1-yl)methyl]phenyl]quinazolin-4-one

Systemtic Name: 2-methyl-3-[2-methyl-5-[(4-phenylpiperazin-1-yl)methyl]phenyl]quinazolin-4-one Openeye Name: 2-methyl-3-[2-methyl-5-[(4-phenylpiperazin-1-yl)methyl]phenyl]quinazolin-4-one CAS Name: 2-methyl-3-[2-methyl-5-[(4-phenyl-1-piperazinyl)methyl]phenyl]-4-quinazolinone IUPAC Name: 2-methyl-3-[2-methyl-5-[(4-phenylpiperazin-1-yl)methyl]phenyl]quinazolin-4-one Traditional Name: 2-methyl-3-[2-methyl-5-[(4-phenylpiperazino)methyl]phenyl]quinazolin-4-one Formula: C27H28N4O MolecularWeight: 424.53742

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)CN2CCN(CC2)C3=CC=CC=C3)N4C(=NC5=CC=CC=C5C4=O)C

Isomeric SMILES

CC1=C(C=C(C=C1)CN2CCN(CC2)C3=CC=CC=C3)N4C(=NC5=CC=CC=C5C4=O)C

InChI

InChI=1S/C27H28N4O/c1-20-12-13-22(19-29-14-16-30(17-15-29)23-8-4-3-5-9-23)18-26(20)31-21(2)28-25-11-7-6-10-24(25)27(31)32/h3-13,18H,14-17,19H2,1-2H3