3-phenyl-2-[(2-propan-2-ylquinazolin-4-yl)sulfanylmethyl]quinazolin-4-one

Systemtic Name: 3-phenyl-2-[(2-propan-2-ylquinazolin-4-yl)sulfanylmethyl]quinazolin-4-one Openeye Name: 2-[(2-isopropylquinazolin-4-yl)sulfanylmethyl]-3-phenyl-quinazolin-4-one CAS Name: 3-phenyl-2-[[(2-propan-2-yl-4-quinazolinyl)thio]methyl]-4-quinazolinone IUPAC Name: 3-phenyl-2-[(2-propan-2-ylquinazolin-4-yl)sulfanylmethyl]quinazolin-4-one Traditional Name: 2-[[(2-isopropylquinazolin-4-yl)thio]methyl]-3-phenyl-quinazolin-4-one Formula: C26H22N4OS MolecularWeight: 438.54408

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NC2=CC=CC=C2C(=N1)SCC3=NC4=CC=CC=C4C(=O)N3C5=CC=CC=C5

Isomeric SMILES

CC(C)C1=NC2=CC=CC=C2C(=N1)SCC3=NC4=CC=CC=C4C(=O)N3C5=CC=CC=C5

InChI

InChI=1S/C26H22N4OS/c1-17(2)24-28-21-14-8-6-12-19(21)25(29-24)32-16-23-27-22-15-9-7-13-20(22)26(31)30(23)18-10-4-3-5-11-18/h3-15,17H,16H2,1-2H3