2-butylsulfanyl-3-[(3,4-dimethoxyphenyl)methyl]quinazolin-4-one

Systemtic Name: 2-butylsulfanyl-3-[(3,4-dimethoxyphenyl)methyl]quinazolin-4-one Openeye Name: 2-butylsulfanyl-3-[(3,4-dimethoxyphenyl)methyl]quinazolin-4-one CAS Name: 2-(butylthio)-3-[(3,4-dimethoxyphenyl)methyl]-4-quinazolinone IUPAC Name: 2-butylsulfanyl-3-[(3,4-dimethoxyphenyl)methyl]quinazolin-4-one Traditional Name: 2-(butylthio)-3-veratryl-quinazolin-4-one Formula: C21H24N2O3S MolecularWeight: 384.49186

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Descriptors Computed from Structure

Canonical SMILES:

CCCCSC1=NC2=CC=CC=C2C(=O)N1CC3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CCCCSC1=NC2=CC=CC=C2C(=O)N1CC3=CC(=C(C=C3)OC)OC

InChI

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