1-phenyl-4-[(E)-3-phenylprop-2-enyl]sulfanyl-pyrazolo[3,4-d]pyrimidine

Systemtic Name: 1-phenyl-4-[(E)-3-phenylprop-2-enyl]sulfanyl-pyrazolo[3,4-d]pyrimidine Openeye Name: 4-[(E)-cinnamyl]sulfanyl-1-phenyl-pyrazolo[3,4-d]pyrimidine CAS Name: 1-phenyl-4-[[(E)-3-phenylprop-2-enyl]thio]pyrazolo[3,4-d]pyrimidine IUPAC Name: 1-phenyl-4-[(E)-3-phenylprop-2-enyl]sulfanylpyrazolo[3,4-d]pyrimidine Traditional Name: 4-[[(E)-cinnamyl]thio]-1-phenyl-pyrazolo[3,4-d]pyrimidine Formula: C20H16N4S MolecularWeight: 344.43284

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C=CCSC2=NC=NC3=C2C=NN3C4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)/C=C/CSC2=NC=NC3=C2C=NN3C4=CC=CC=C4

InChI

InChI=1S/C20H16N4S/c1-3-8-16(9-4-1)10-7-13-25-20-18-14-23-24(19(18)21-15-22-20)17-11-5-2-6-12-17/h1-12,14-15H,13H2/b10-7+