2-(1,3-benzodioxol-5-ylmethylsulfanyl)-7-chloranyl-3-propan-2-yl-quinazolin-4-one

Systemtic Name: 2-(1,3-benzodioxol-5-ylmethylsulfanyl)-7-chloranyl-3-propan-2-yl-quinazolin-4-one Openeye Name: 2-(1,3-benzodioxol-5-ylmethylsulfanyl)-7-chloro-3-isopropyl-quinazolin-4-one CAS Name: 2-(1,3-benzodioxol-5-ylmethylthio)-7-chloro-3-propan-2-yl-4-quinazolinone IUPAC Name: 2-(1,3-benzodioxol-5-ylmethylsulfanyl)-7-chloro-3-propan-2-ylquinazolin-4-one Traditional Name: 7-chloro-3-isopropyl-2-(piperonylthio)quinazolin-4-one Formula: C19H17ClN2O3S MolecularWeight: 388.86788

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C(=O)C2=C(C=C(C=C2)Cl)N=C1SCC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CC(C)N1C(=O)C2=C(C=C(C=C2)Cl)N=C1SCC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C19H17ClN2O3S/c1-11(2)22-18(23)14-5-4-13(20)8-15(14)21-19(22)26-9-12-3-6-16-17(7-12)25-10-24-16/h3-8,11H,9-10H2,1-2H3