2-azanyl-3,5-dimethyl-7-prop-2-ynyl-6-[(3,4,5-trimethoxyphenyl)amino]quinazolin-4-one

Systemtic Name: 2-azanyl-3,5-dimethyl-7-prop-2-ynyl-6-[(3,4,5-trimethoxyphenyl)amino]quinazolin-4-one Openeye Name: 2-amino-3,5-dimethyl-7-prop-2-ynyl-6-(3,4,5-trimethoxyanilino)quinazolin-4-one CAS Name: 2-amino-3,5-dimethyl-7-prop-2-ynyl-6-(3,4,5-trimethoxyanilino)-4-quinazolinone IUPAC Name: 2-amino-3,5-dimethyl-7-prop-2-ynyl-6-(3,4,5-trimethoxyanilino)quinazolin-4-one Traditional Name: 2-amino-3,5-dimethyl-7-propargyl-6-(3,4,5-trimethoxyanilino)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)C)CC#C)NC3=CC(=C(C(=C3)OC)OC)OC

Isomeric SMILES

CC1=C(C(=CC2=C1C(=O)N(C(=N2)N)C)CC#C)NC3=CC(=C(C(=C3)OC)OC)OC

InChI

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