4-phenyl-3-(1-phenyl-5-pyrrol-1-yl-pyrazol-4-yl)-5-propylsulfanyl-1,2,4-triazole

Systemtic Name: 4-phenyl-3-(1-phenyl-5-pyrrol-1-yl-pyrazol-4-yl)-5-propylsulfanyl-1,2,4-triazole Openeye Name: 4-phenyl-3-(1-phenyl-5-pyrrol-1-yl-pyrazol-4-yl)-5-propylsulfanyl-1,2,4-triazole CAS Name: 4-phenyl-3-[1-phenyl-5-(1-pyrrolyl)-4-pyrazolyl]-5-(propylthio)-1,2,4-triazole IUPAC Name: 4-phenyl-3-(1-phenyl-5-pyrrol-1-ylpyrazol-4-yl)-5-propylsulfanyl-1,2,4-triazole Traditional Name: 4-phenyl-3-(1-phenyl-5-pyrrol-1-yl-pyrazol-4-yl)-5-(propylthio)-1,2,4-triazole Formula: C24H22N6S MolecularWeight: 426.53668

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Descriptors Computed from Structure

Canonical SMILES:

CCCSC1=NN=C(N1C2=CC=CC=C2)C3=C(N(N=C3)C4=CC=CC=C4)N5C=CC=C5

Isomeric SMILES

CCCSC1=NN=C(N1C2=CC=CC=C2)C3=C(N(N=C3)C4=CC=CC=C4)N5C=CC=C5

InChI

InChI=1S/C24H22N6S/c1-2-17-31-24-27-26-22(29(24)19-11-5-3-6-12-19)21-18-25-30(20-13-7-4-8-14-20)23(21)28-15-9-10-16-28/h3-16,18H,2,17H2,1H3