4-[(4-pyrazol-1-ylphenyl)methylsulfanyl]-[1]benzofuro[3,2-d]pyrimidine

Systemtic Name: 4-[(4-pyrazol-1-ylphenyl)methylsulfanyl]-[1]benzofuro[3,2-d]pyrimidine Openeye Name: 4-[(4-pyrazol-1-ylphenyl)methylsulfanyl]benzofuro[3,2-d]pyrimidine CAS Name: 4-[[4-(1-pyrazolyl)phenyl]methylthio]benzofuro[3,2-d]pyrimidine IUPAC Name: 4-[(4-pyrazol-1-ylphenyl)methylsulfanyl]-[1]benzofuro[3,2-d]pyrimidine Traditional Name: 4-[(4-pyrazol-1-ylbenzyl)thio]benzofuro[3,2-d]pyrimidine Formula: C20H14N4OS MolecularWeight: 358.41636

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C3=C(O2)C(=NC=N3)SCC4=CC=C(C=C4)N5C=CC=N5

Isomeric SMILES

C1=CC=C2C(=C1)C3=C(O2)C(=NC=N3)SCC4=CC=C(C=C4)N5C=CC=N5

InChI

InChI=1S/C20H14N4OS/c1-2-5-17-16(4-1)18-19(25-17)20(22-13-21-18)26-12-14-6-8-15(9-7-14)24-11-3-10-23-24/h1-11,13H,12H2