2-[(4-methylphenyl)methylsulfanyl]-4-phenoxy-[1]benzothiolo[3,2-d]pyrimidine

Systemtic Name: 2-[(4-methylphenyl)methylsulfanyl]-4-phenoxy-[1]benzothiolo[3,2-d]pyrimidine Openeye Name: 4-phenoxy-2-(p-tolylmethylsulfanyl)benzothiopheno[3,2-d]pyrimidine CAS Name: 2-[(4-methylphenyl)methylthio]-4-phenoxy-[1]benzothiolo[3,2-d]pyrimidine IUPAC Name: 2-[(4-methylphenyl)methylsulfanyl]-4-phenoxy-[1]benzothiolo[3,2-d]pyrimidine Traditional Name: 2-[(4-methylbenzyl)thio]-4-phenoxy-benzothiopheno[3,2-d]pyrimidine Formula: C24H18N2OS2 MolecularWeight: 414.54252

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CSC2=NC3=C(C(=N2)OC4=CC=CC=C4)SC5=CC=CC=C53

Isomeric SMILES

CC1=CC=C(C=C1)CSC2=NC3=C(C(=N2)OC4=CC=CC=C4)SC5=CC=CC=C53

InChI

InChI=1S/C24H18N2OS2/c1-16-11-13-17(14-12-16)15-28-24-25-21-19-9-5-6-10-20(19)29-22(21)23(26-24)27-18-7-3-2-4-8-18/h2-14H,15H2,1H3