3-(4-butan-2-ylphenyl)-2-(naphthalen-1-ylmethylsulfanyl)quinazolin-4-one

Systemtic Name: 3-(4-butan-2-ylphenyl)-2-(naphthalen-1-ylmethylsulfanyl)quinazolin-4-one Openeye Name: 2-(1-naphthylmethylsulfanyl)-3-(4-sec-butylphenyl)quinazolin-4-one CAS Name: 3-(4-butan-2-ylphenyl)-2-(1-naphthalenylmethylthio)-4-quinazolinone IUPAC Name: 3-(4-butan-2-ylphenyl)-2-(naphthalen-1-ylmethylsulfanyl)quinazolin-4-one Traditional Name: 2-(1-naphthylmethylthio)-3-(4-sec-butylphenyl)quinazolin-4-one Formula: C29H26N2OS MolecularWeight: 450.59454

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C29H26N2OS/c1-3-20(2)21-15-17-24(18-16-21)31-28(32)26-13-6-7-14-27(26)30-29(31)33-19-23-11-8-10-22-9-4-5-12-25(22)23/h4-18,20H,3,19H2,1-2H3