3-cyclopropyl-5-[[3-(4-methoxyphenyl)-1-phenyl-pyrazol-4-yl]methylsulfanyl]-4-prop-2-enyl-1,2,4-triazole

Systemtic Name: 3-cyclopropyl-5-[[3-(4-methoxyphenyl)-1-phenyl-pyrazol-4-yl]methylsulfanyl]-4-prop-2-enyl-1,2,4-triazole Openeye Name: 4-allyl-3-cyclopropyl-5-[[3-(4-methoxyphenyl)-1-phenyl-pyrazol-4-yl]methylsulfanyl]-1,2,4-triazole CAS Name: 3-cyclopropyl-5-[[3-(4-methoxyphenyl)-1-phenyl-4-pyrazolyl]methylthio]-4-prop-2-enyl-1,2,4-triazole IUPAC Name: 3-cyclopropyl-5-[[3-(4-methoxyphenyl)-1-phenylpyrazol-4-yl]methylsulfanyl]-4-prop-2-enyl-1,2,4-triazole Traditional Name: 4-allyl-3-cyclopropyl-5-[[3-(4-methoxyphenyl)-1-phenyl-pyrazol-4-yl]methylthio]-1,2,4-triazole Formula: C25H25N5OS MolecularWeight: 443.5639

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NN(C=C2CSC3=NN=C(N3CC=C)C4CC4)C5=CC=CC=C5

Isomeric SMILES

COC1=CC=C(C=C1)C2=NN(C=C2CSC3=NN=C(N3CC=C)C4CC4)C5=CC=CC=C5

InChI

InChI=1S/C25H25N5OS/c1-3-15-29-24(19-9-10-19)26-27-25(29)32-17-20-16-30(21-7-5-4-6-8-21)28-23(20)18-11-13-22(31-2)14-12-18/h3-8,11-14,16,19H,1,9-10,15,17H2,2H3