3-(4-ethylphenyl)-2-(naphthalen-1-ylmethylsulfanyl)quinazolin-4-one

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

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SCC4=CC=CC5=CC=CC=C54

Isomeric SMILES

CCC1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SCC4=CC=CC5=CC=CC=C54

InChI

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