8-methyl-2-[5-[(E)-3-(4-methylpiperazin-1-yl)-3-oxidanylidene-prop-1-enyl]-2-propoxy-phenyl]-1H-quinazolin-4-one

Systemtic Name: 8-methyl-2-[5-[(E)-3-(4-methylpiperazin-1-yl)-3-oxidanylidene-prop-1-enyl]-2-propoxy-phenyl]-1H-quinazolin-4-one Openeye Name: 8-methyl-2-[5-[(E)-3-(4-methylpiperazin-1-yl)-3-oxo-prop-1-enyl]-2-propoxy-phenyl]-1H-quinazolin-4-one CAS Name: 8-methyl-2-[5-[(E)-3-(4-methyl-1-piperazinyl)-3-oxoprop-1-enyl]-2-propoxyphenyl]-1H-quinazolin-4-one IUPAC Name: 8-methyl-2-[5-[(E)-3-(4-methylpiperazin-1-yl)-3-oxoprop-1-enyl]-2-propoxyphenyl]-1H-quinazolin-4-one Traditional Name: 2-[5-[(E)-3-keto-3-(4-methylpiperazino)prop-1-enyl]-2-propoxy-phenyl]-8-methyl-1H-quinazolin-4-one Formula: C26H30N4O3 MolecularWeight: 446.5414

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)C=CC(=O)N2CCN(CC2)C)C3=NC(=O)C4=C(N3)C(=CC=C4)C

Isomeric SMILES

CCCOC1=C(C=C(C=C1)/C=C/C(=O)N2CCN(CC2)C)C3=NC(=O)C4=C(N3)C(=CC=C4)C

InChI

InChI=1S/C26H30N4O3/c1-4-16-33-22-10-8-19(9-11-23(31)30-14-12-29(3)13-15-30)17-21(22)25-27-24-18(2)6-5-7-20(24)26(32)28-25/h5-11,17H,4,12-16H2,1-3H3,(H,27,28,32)/b11-9+