4-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)-2-methyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidine

Systemtic Name: 4-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)-2-methyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidine Openeye Name: 4-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)-2-methyl-5,6,7,8-tetrahydrobenzothiopheno[2,3-d]pyrimidine CAS Name: 4-(2,3-dihydro-1,4-benzodioxin-6-ylthio)-2-methyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidine IUPAC Name: 4-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)-2-methyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidine Traditional Name: 4-(2,3-dihydro-1,4-benzodioxin-6-ylthio)-2-methyl-5,6,7,8-tetrahydrobenzothiopheno[2,3-d]pyrimidine Formula: C19H18N2O2S2 MolecularWeight: 370.48842

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C3=C(S2)CCCC3)C(=N1)SC4=CC5=C(C=C4)OCCO5

Isomeric SMILES

CC1=NC2=C(C3=C(S2)CCCC3)C(=N1)SC4=CC5=C(C=C4)OCCO5

InChI

InChI=1S/C19H18N2O2S2/c1-11-20-18(17-13-4-2-3-5-16(13)25-19(17)21-11)24-12-6-7-14-15(10-12)23-9-8-22-14/h6-7,10H,2-5,8-9H2,1H3