3-[(4-ethanoylphenyl)methyl]-6-[3-(4-methoxyphenyl)prop-1-ynyl]quinazolin-4-one

Systemtic Name: 3-[(4-ethanoylphenyl)methyl]-6-[3-(4-methoxyphenyl)prop-1-ynyl]quinazolin-4-one Openeye Name: 3-[(4-acetylphenyl)methyl]-6-[3-(4-methoxyphenyl)prop-1-ynyl]quinazolin-4-one CAS Name: 3-[(4-acetylphenyl)methyl]-6-[3-(4-methoxyphenyl)prop-1-ynyl]-4-quinazolinone IUPAC Name: 3-[(4-acetylphenyl)methyl]-6-[3-(4-methoxyphenyl)prop-1-ynyl]quinazolin-4-one Traditional Name: 3-(4-acetylbenzyl)-6-[3-(4-methoxyphenyl)prop-1-ynyl]quinazolin-4-one Formula: C27H22N2O3 MolecularWeight: 422.47518

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)CN2C=NC3=C(C2=O)C=C(C=C3)C#CCC4=CC=C(C=C4)OC

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)CN2C=NC3=C(C2=O)C=C(C=C3)C#CCC4=CC=C(C=C4)OC

InChI

InChI=1S/C27H22N2O3/c1-19(30)23-11-6-22(7-12-23)17-29-18-28-26-15-10-21(16-25(26)27(29)31)5-3-4-20-8-13-24(32-2)14-9-20/h6-16,18H,4,17H2,1-2H3