2-(1,3-benzodioxol-5-ylmethylsulfanyl)-3-ethyl-quinazolin-4-one

Systemtic Name: 2-(1,3-benzodioxol-5-ylmethylsulfanyl)-3-ethyl-quinazolin-4-one Openeye Name: 2-(1,3-benzodioxol-5-ylmethylsulfanyl)-3-ethyl-quinazolin-4-one CAS Name: 2-(1,3-benzodioxol-5-ylmethylthio)-3-ethyl-4-quinazolinone IUPAC Name: 2-(1,3-benzodioxol-5-ylmethylsulfanyl)-3-ethylquinazolin-4-one Traditional Name: 3-ethyl-2-(piperonylthio)quinazolin-4-one Formula: C18H16N2O3S MolecularWeight: 340.39624

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C2=CC=CC=C2N=C1SCC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CCN1C(=O)C2=CC=CC=C2N=C1SCC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C18H16N2O3S/c1-2-20-17(21)13-5-3-4-6-14(13)19-18(20)24-10-12-7-8-15-16(9-12)23-11-22-15/h3-9H,2,10-11H2,1H3