2-(3-methylbutylsulfanyl)-3-(phenylmethyl)quinazolin-4-one

Systemtic Name: 2-(3-methylbutylsulfanyl)-3-(phenylmethyl)quinazolin-4-one Openeye Name: 3-benzyl-2-isopentylsulfanyl-quinazolin-4-one CAS Name: 2-(3-methylbutylthio)-3-(phenylmethyl)-4-quinazolinone IUPAC Name: 3-benzyl-2-(3-methylbutylsulfanyl)quinazolin-4-one Traditional Name: 3-benzyl-2-(isoamylthio)quinazolin-4-one Formula: C20H22N2OS MolecularWeight: 338.46648

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCSC1=NC2=CC=CC=C2C(=O)N1CC3=CC=CC=C3

Isomeric SMILES

CC(C)CCSC1=NC2=CC=CC=C2C(=O)N1CC3=CC=CC=C3

InChI

InChI=1S/C20H22N2OS/c1-15(2)12-13-24-20-21-18-11-7-6-10-17(18)19(23)22(20)14-16-8-4-3-5-9-16/h3-11,15H,12-14H2,1-2H3