3-(4-methoxyphenyl)-2-pentylsulfanyl-quinazolin-4-one

Systemtic Name: 3-(4-methoxyphenyl)-2-pentylsulfanyl-quinazolin-4-one Openeye Name: 3-(4-methoxyphenyl)-2-pentylsulfanyl-quinazolin-4-one CAS Name: 3-(4-methoxyphenyl)-2-(pentylthio)-4-quinazolinone IUPAC Name: 3-(4-methoxyphenyl)-2-pentylsulfanylquinazolin-4-one Traditional Name: 2-(amylthio)-3-(4-methoxyphenyl)quinazolin-4-one Formula: C20H22N2O2S MolecularWeight: 354.46588

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCSC1=NC2=CC=CC=C2C(=O)N1C3=CC=C(C=C3)OC

Isomeric SMILES

CCCCCSC1=NC2=CC=CC=C2C(=O)N1C3=CC=C(C=C3)OC

InChI

InChI=1S/C20H22N2O2S/c1-3-4-7-14-25-20-21-18-9-6-5-8-17(18)19(23)22(20)15-10-12-16(24-2)13-11-15/h5-6,8-13H,3-4,7,14H2,1-2H3