3-(1,3-benzodioxol-5-ylmethyl)-2-prop-2-enylsulfanyl-thieno[3,2-d]pyrimidin-4-one

Systemtic Name: 3-(1,3-benzodioxol-5-ylmethyl)-2-prop-2-enylsulfanyl-thieno[3,2-d]pyrimidin-4-one Openeye Name: 2-allylsulfanyl-3-(1,3-benzodioxol-5-ylmethyl)thieno[3,2-d]pyrimidin-4-one CAS Name: 3-(1,3-benzodioxol-5-ylmethyl)-2-(prop-2-enylthio)-4-thieno[3,2-d]pyrimidinone IUPAC Name: 3-(1,3-benzodioxol-5-ylmethyl)-2-prop-2-enylsulfanylthieno[3,2-d]pyrimidin-4-one Traditional Name: 2-(allylthio)-3-piperonyl-thieno[3,2-d]pyrimidin-4-one Formula: C17H14N2O3S2 MolecularWeight: 358.43466

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Descriptors Computed from Structure

Canonical SMILES:

C=CCSC1=NC2=C(C(=O)N1CC3=CC4=C(C=C3)OCO4)SC=C2

Isomeric SMILES

C=CCSC1=NC2=C(C(=O)N1CC3=CC4=C(C=C3)OCO4)SC=C2

InChI

InChI=1S/C17H14N2O3S2/c1-2-6-24-17-18-12-5-7-23-15(12)16(20)19(17)9-11-3-4-13-14(8-11)22-10-21-13/h2-5,7-8H,1,6,9-10H2