3-butyl-2-[(2,5-dimethoxyphenyl)methylsulfanyl]quinazolin-4-one

Systemtic Name: 3-butyl-2-[(2,5-dimethoxyphenyl)methylsulfanyl]quinazolin-4-one Openeye Name: 3-butyl-2-[(2,5-dimethoxyphenyl)methylsulfanyl]quinazolin-4-one CAS Name: 3-butyl-2-[(2,5-dimethoxyphenyl)methylthio]-4-quinazolinone IUPAC Name: 3-butyl-2-[(2,5-dimethoxyphenyl)methylsulfanyl]quinazolin-4-one Traditional Name: 3-butyl-2-[(2,5-dimethoxybenzyl)thio]quinazolin-4-one Formula: C21H24N2O3S MolecularWeight: 384.49186

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C2=CC=CC=C2N=C1SCC3=C(C=CC(=C3)OC)OC

Isomeric SMILES

CCCCN1C(=O)C2=CC=CC=C2N=C1SCC3=C(C=CC(=C3)OC)OC

InChI

InChI=1S/C21H24N2O3S/c1-4-5-12-23-20(24)17-8-6-7-9-18(17)22-21(23)27-14-15-13-16(25-2)10-11-19(15)26-3/h6-11,13H,4-5,12,14H2,1-3H3