2-(1,3-benzodioxol-5-ylmethylsulfanyl)-6-chloranyl-quinazoline

Systemtic Name: 2-(1,3-benzodioxol-5-ylmethylsulfanyl)-6-chloranyl-quinazoline Openeye Name: 2-(1,3-benzodioxol-5-ylmethylsulfanyl)-6-chloro-quinazoline CAS Name: 2-(1,3-benzodioxol-5-ylmethylthio)-6-chloroquinazoline IUPAC Name: 2-(1,3-benzodioxol-5-ylmethylsulfanyl)-6-chloroquinazoline Traditional Name: 6-chloro-2-(piperonylthio)quinazoline Formula: C16H11ClN2O2S MolecularWeight: 330.78874

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CSC3=NC=C4C=C(C=CC4=N3)Cl

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CSC3=NC=C4C=C(C=CC4=N3)Cl

InChI

InChI=1S/C16H11ClN2O2S/c17-12-2-3-13-11(6-12)7-18-16(19-13)22-8-10-1-4-14-15(5-10)21-9-20-14/h1-7H,8-9H2