4-[(1,3-diphenylpyrazol-4-yl)methylsulfanyl]-2,5,6-trimethyl-thieno[2,3-d]pyrimidine

Systemtic Name: 4-[(1,3-diphenylpyrazol-4-yl)methylsulfanyl]-2,5,6-trimethyl-thieno[2,3-d]pyrimidine Openeye Name: 4-[(1,3-diphenylpyrazol-4-yl)methylsulfanyl]-2,5,6-trimethyl-thieno[2,3-d]pyrimidine CAS Name: 4-[(1,3-diphenyl-4-pyrazolyl)methylthio]-2,5,6-trimethylthieno[2,3-d]pyrimidine IUPAC Name: 4-[(1,3-diphenylpyrazol-4-yl)methylsulfanyl]-2,5,6-trimethylthieno[2,3-d]pyrimidine Traditional Name: 4-[(1,3-diphenylpyrazol-4-yl)methylthio]-2,5,6-trimethyl-thieno[2,3-d]pyrimidine Formula: C25H22N4S2 MolecularWeight: 442.59898

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=NC(=N2)C)SCC3=CN(N=C3C4=CC=CC=C4)C5=CC=CC=C5)C

Isomeric SMILES

CC1=C(SC2=C1C(=NC(=N2)C)SCC3=CN(N=C3C4=CC=CC=C4)C5=CC=CC=C5)C

InChI

InChI=1S/C25H22N4S2/c1-16-17(2)31-25-22(16)24(26-18(3)27-25)30-15-20-14-29(21-12-8-5-9-13-21)28-23(20)19-10-6-4-7-11-19/h4-14H,15H2,1-3H3