3-(3,5-dimethylphenyl)-2-(naphthalen-1-ylmethylsulfanyl)quinazolin-4-one

Systemtic Name: 3-(3,5-dimethylphenyl)-2-(naphthalen-1-ylmethylsulfanyl)quinazolin-4-one Openeye Name: 3-(3,5-dimethylphenyl)-2-(1-naphthylmethylsulfanyl)quinazolin-4-one CAS Name: 3-(3,5-dimethylphenyl)-2-(1-naphthalenylmethylthio)-4-quinazolinone IUPAC Name: 3-(3,5-dimethylphenyl)-2-(naphthalen-1-ylmethylsulfanyl)quinazolin-4-one Traditional Name: 3-(3,5-dimethylphenyl)-2-(1-naphthylmethylthio)quinazolin-4-one Formula: C27H22N2OS MolecularWeight: 422.54138

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)N2C(=O)C3=CC=CC=C3N=C2SCC4=CC=CC5=CC=CC=C54)C

Isomeric SMILES

CC1=CC(=CC(=C1)N2C(=O)C3=CC=CC=C3N=C2SCC4=CC=CC5=CC=CC=C54)C

InChI

InChI=1S/C27H22N2OS/c1-18-14-19(2)16-22(15-18)29-26(30)24-12-5-6-13-25(24)28-27(29)31-17-21-10-7-9-20-8-3-4-11-23(20)21/h3-16H,17H2,1-2H3