4-(4-methoxyphenyl)sulfanyl-2-(phenylmethylsulfanyl)-[1]benzothiolo[3,2-d]pyrimidine

Systemtic Name: 4-(4-methoxyphenyl)sulfanyl-2-(phenylmethylsulfanyl)-[1]benzothiolo[3,2-d]pyrimidine Openeye Name: 2-benzylsulfanyl-4-(4-methoxyphenyl)sulfanyl-benzothiopheno[3,2-d]pyrimidine CAS Name: 4-[(4-methoxyphenyl)thio]-2-(phenylmethylthio)-[1]benzothiolo[3,2-d]pyrimidine IUPAC Name: 2-benzylsulfanyl-4-(4-methoxyphenyl)sulfanyl-[1]benzothiolo[3,2-d]pyrimidine Traditional Name: 2-(benzylthio)-4-[(4-methoxyphenyl)thio]benzothiopheno[3,2-d]pyrimidine Formula: C24H18N2OS3 MolecularWeight: 446.60752

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)SC2=NC(=NC3=C2SC4=CC=CC=C43)SCC5=CC=CC=C5

Isomeric SMILES

COC1=CC=C(C=C1)SC2=NC(=NC3=C2SC4=CC=CC=C43)SCC5=CC=CC=C5

InChI

InChI=1S/C24H18N2OS3/c1-27-17-11-13-18(14-12-17)29-23-22-21(19-9-5-6-10-20(19)30-22)25-24(26-23)28-15-16-7-3-2-4-8-16/h2-14H,15H2,1H3