4-cyclopropyl-3-[(1,3-diphenylpyrazol-4-yl)methylsulfanyl]-5-methyl-1,2,4-triazole

Systemtic Name: 4-cyclopropyl-3-[(1,3-diphenylpyrazol-4-yl)methylsulfanyl]-5-methyl-1,2,4-triazole Openeye Name: 4-cyclopropyl-3-[(1,3-diphenylpyrazol-4-yl)methylsulfanyl]-5-methyl-1,2,4-triazole CAS Name: 4-cyclopropyl-3-[(1,3-diphenyl-4-pyrazolyl)methylthio]-5-methyl-1,2,4-triazole IUPAC Name: 4-cyclopropyl-3-[(1,3-diphenylpyrazol-4-yl)methylsulfanyl]-5-methyl-1,2,4-triazole Traditional Name: 4-cyclopropyl-3-[(1,3-diphenylpyrazol-4-yl)methylthio]-5-methyl-1,2,4-triazole Formula: C22H21N5S MolecularWeight: 387.50064

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(N1C2CC2)SCC3=CN(N=C3C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CC1=NN=C(N1C2CC2)SCC3=CN(N=C3C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C22H21N5S/c1-16-23-24-22(27(16)20-12-13-20)28-15-18-14-26(19-10-6-3-7-11-19)25-21(18)17-8-4-2-5-9-17/h2-11,14,20H,12-13,15H2,1H3