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

Systemtic Name: 4-(4-methylphenyl)sulfanyl-2-(phenylmethylsulfanyl)-[1]benzothiolo[3,2-d]pyrimidine Openeye Name: 2-benzylsulfanyl-4-(p-tolylsulfanyl)benzothiopheno[3,2-d]pyrimidine CAS Name: 4-[(4-methylphenyl)thio]-2-(phenylmethylthio)-[1]benzothiolo[3,2-d]pyrimidine IUPAC Name: 2-benzylsulfanyl-4-(4-methylphenyl)sulfanyl-[1]benzothiolo[3,2-d]pyrimidine Traditional Name: 2-(benzylthio)-4-(p-tolylthio)benzothiopheno[3,2-d]pyrimidine Formula: C24H18N2S3 MolecularWeight: 430.60812

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SC2=NC(=NC3=C2SC4=CC=CC=C43)SCC5=CC=CC=C5

Isomeric SMILES

CC1=CC=C(C=C1)SC2=NC(=NC3=C2SC4=CC=CC=C43)SCC5=CC=CC=C5

InChI

InChI=1S/C24H18N2S3/c1-16-11-13-18(14-12-16)28-23-22-21(19-9-5-6-10-20(19)29-22)25-24(26-23)27-15-17-7-3-2-4-8-17/h2-14H,15H2,1H3