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

Systemtic Name: 4-methyl-3-(1-phenyl-5-pyrrol-1-yl-pyrazol-4-yl)-5-propylsulfanyl-1,2,4-triazole Openeye Name: 4-methyl-3-(1-phenyl-5-pyrrol-1-yl-pyrazol-4-yl)-5-propylsulfanyl-1,2,4-triazole CAS Name: 4-methyl-3-[1-phenyl-5-(1-pyrrolyl)-4-pyrazolyl]-5-(propylthio)-1,2,4-triazole IUPAC Name: 4-methyl-3-(1-phenyl-5-pyrrol-1-ylpyrazol-4-yl)-5-propylsulfanyl-1,2,4-triazole Traditional Name: 4-methyl-3-(1-phenyl-5-pyrrol-1-yl-pyrazol-4-yl)-5-(propylthio)-1,2,4-triazole Formula: C19H20N6S MolecularWeight: 364.4673

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Descriptors Computed from Structure

Canonical SMILES:

CCCSC1=NN=C(N1C)C2=C(N(N=C2)C3=CC=CC=C3)N4C=CC=C4

Isomeric SMILES

CCCSC1=NN=C(N1C)C2=C(N(N=C2)C3=CC=CC=C3)N4C=CC=C4

InChI

InChI=1S/C19H20N6S/c1-3-13-26-19-22-21-17(23(19)2)16-14-20-25(15-9-5-4-6-10-15)18(16)24-11-7-8-12-24/h4-12,14H,3,13H2,1-2H3