4-[(1-cyclopropylimidazol-2-yl)sulfanylmethyl]-3-(4-methoxyphenyl)-1-phenyl-pyrazole

Systemtic Name: 4-[(1-cyclopropylimidazol-2-yl)sulfanylmethyl]-3-(4-methoxyphenyl)-1-phenyl-pyrazole Openeye Name: 4-[(1-cyclopropylimidazol-2-yl)sulfanylmethyl]-3-(4-methoxyphenyl)-1-phenyl-pyrazole CAS Name: 4-[[(1-cyclopropyl-2-imidazolyl)thio]methyl]-3-(4-methoxyphenyl)-1-phenylpyrazole IUPAC Name: 4-[(1-cyclopropylimidazol-2-yl)sulfanylmethyl]-3-(4-methoxyphenyl)-1-phenylpyrazole Traditional Name: 4-[[(1-cyclopropylimidazol-2-yl)thio]methyl]-3-(4-methoxyphenyl)-1-phenyl-pyrazole Formula: C23H22N4OS MolecularWeight: 402.51198

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NN(C=C2CSC3=NC=CN3C4CC4)C5=CC=CC=C5

Isomeric SMILES

COC1=CC=C(C=C1)C2=NN(C=C2CSC3=NC=CN3C4CC4)C5=CC=CC=C5

InChI

InChI=1S/C23H22N4OS/c1-28-21-11-7-17(8-12-21)22-18(15-27(25-22)20-5-3-2-4-6-20)16-29-23-24-13-14-26(23)19-9-10-19/h2-8,11-15,19H,9-10,16H2,1H3