5-(4-methoxyphenyl)-2,4,4-tris(propan-2-ylsulfanyl)pyrazol-3-one

Systemtic Name: 5-(4-methoxyphenyl)-2,4,4-tris(propan-2-ylsulfanyl)pyrazol-3-one Openeye Name: 2,4,4-tris(isopropylsulfanyl)-5-(4-methoxyphenyl)pyrazol-3-one CAS Name: 5-(4-methoxyphenyl)-2,4,4-tris(propan-2-ylthio)-3-pyrazolone IUPAC Name: 5-(4-methoxyphenyl)-2,4,4-tris(propan-2-ylsulfanyl)pyrazol-3-one Traditional Name: 2,4,4-tris(isopropylthio)-5-(4-methoxyphenyl)-2-pyrazolin-3-one Formula: C19H28N2O2S3 MolecularWeight: 412.63282

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)SC1(C(=NN(C1=O)SC(C)C)C2=CC=C(C=C2)OC)SC(C)C

Isomeric SMILES

CC(C)SC1(C(=NN(C1=O)SC(C)C)C2=CC=C(C=C2)OC)SC(C)C

InChI

InChI=1S/C19H28N2O2S3/c1-12(2)24-19(25-13(3)4)17(15-8-10-16(23-7)11-9-15)20-21(18(19)22)26-14(5)6/h8-14H,1-7H3