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

Systemtic Name: 7-methyl-4-prop-2-enylsulfanyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidine Openeye Name: 4-allylsulfanyl-7-methyl-5,6,7,8-tetrahydrobenzothiopheno[2,3-d]pyrimidine CAS Name: 7-methyl-4-(prop-2-enylthio)-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidine IUPAC Name: 7-methyl-4-prop-2-enylsulfanyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidine Traditional Name: 4-(allylthio)-7-methyl-5,6,7,8-tetrahydrobenzothiopheno[2,3-d]pyrimidine Formula: C14H16N2S2 MolecularWeight: 276.42024

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2=C(C1)SC3=C2C(=NC=N3)SCC=C

Isomeric SMILES

CC1CCC2=C(C1)SC3=C2C(=NC=N3)SCC=C

InChI

InChI=1S/C14H16N2S2/c1-3-6-17-13-12-10-5-4-9(2)7-11(10)18-14(12)16-8-15-13/h3,8-9H,1,4-7H2,2H3