3-[(4-methylphenyl)methyl]-2-(3-phenoxypropylsulfanyl)quinazolin-4-one

Systemtic Name: 3-[(4-methylphenyl)methyl]-2-(3-phenoxypropylsulfanyl)quinazolin-4-one Openeye Name: 2-(3-phenoxypropylsulfanyl)-3-(p-tolylmethyl)quinazolin-4-one CAS Name: 3-[(4-methylphenyl)methyl]-2-(3-phenoxypropylthio)-4-quinazolinone IUPAC Name: 3-[(4-methylphenyl)methyl]-2-(3-phenoxypropylsulfanyl)quinazolin-4-one Traditional Name: 3-(4-methylbenzyl)-2-(3-phenoxypropylthio)quinazolin-4-one Formula: C25H24N2O2S MolecularWeight: 416.53526

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN2C(=O)C3=CC=CC=C3N=C2SCCCOC4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)CN2C(=O)C3=CC=CC=C3N=C2SCCCOC4=CC=CC=C4

InChI

InChI=1S/C25H24N2O2S/c1-19-12-14-20(15-13-19)18-27-24(28)22-10-5-6-11-23(22)26-25(27)30-17-7-16-29-21-8-3-2-4-9-21/h2-6,8-15H,7,16-18H2,1H3