2-azanyl-5-methyl-6-prop-2-ynyl-3-[[(3,4,5-trimethoxyphenyl)amino]methyl]quinazolin-4-one

Systemtic Name: 2-azanyl-5-methyl-6-prop-2-ynyl-3-[[(3,4,5-trimethoxyphenyl)amino]methyl]quinazolin-4-one Openeye Name: 2-amino-5-methyl-6-prop-2-ynyl-3-[(3,4,5-trimethoxyanilino)methyl]quinazolin-4-one CAS Name: 2-amino-5-methyl-6-prop-2-ynyl-3-[(3,4,5-trimethoxyanilino)methyl]-4-quinazolinone IUPAC Name: 2-amino-5-methyl-6-prop-2-ynyl-3-[(3,4,5-trimethoxyanilino)methyl]quinazolin-4-one Traditional Name: 2-amino-5-methyl-6-propargyl-3-[(3,4,5-trimethoxyanilino)methyl]quinazolin-4-one Formula: C22H24N4O4 MolecularWeight: 408.45036

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC2=C1C(=O)N(C(=N2)N)CNC3=CC(=C(C(=C3)OC)OC)OC)CC#C

Isomeric SMILES

CC1=C(C=CC2=C1C(=O)N(C(=N2)N)CNC3=CC(=C(C(=C3)OC)OC)OC)CC#C

InChI

InChI=1S/C22H24N4O4/c1-6-7-14-8-9-16-19(13(14)2)21(27)26(22(23)25-16)12-24-15-10-17(28-3)20(30-5)18(11-15)29-4/h1,8-11,24H,7,12H2,2-5H3,(H2,23,25)