4-chloranyl-2-prop-2-enylsulfanyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidine

Systemtic Name: 4-chloranyl-2-prop-2-enylsulfanyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidine Openeye Name: 2-allylsulfanyl-4-chloro-5,6,7,8-tetrahydrobenzothiopheno[2,3-d]pyrimidine CAS Name: 4-chloro-2-(prop-2-enylthio)-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidine IUPAC Name: 4-chloro-2-prop-2-enylsulfanyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidine Traditional Name: 2-(allylthio)-4-chloro-5,6,7,8-tetrahydrobenzothiopheno[2,3-d]pyrimidine Formula: C13H13ClN2S2 MolecularWeight: 296.83872

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Descriptors Computed from Structure

Canonical SMILES:

C=CCSC1=NC2=C(C3=C(S2)CCCC3)C(=N1)Cl

Isomeric SMILES

C=CCSC1=NC2=C(C3=C(S2)CCCC3)C(=N1)Cl

InChI

InChI=1S/C13H13ClN2S2/c1-2-7-17-13-15-11(14)10-8-5-3-4-6-9(8)18-12(10)16-13/h2H,1,3-7H2