1-[2-[4-[2-(4-methoxyphenyl)-5-methylsulfanyl-pyrazol-3-yl]phenoxy]ethyl]urea

Systemtic Name: 1-[2-[4-[2-(4-methoxyphenyl)-5-methylsulfanyl-pyrazol-3-yl]phenoxy]ethyl]urea Openeye Name: 2-[4-[2-(4-methoxyphenyl)-5-methylsulfanyl-pyrazol-3-yl]phenoxy]ethylurea CAS Name: 2-[4-[2-(4-methoxyphenyl)-5-(methylthio)-3-pyrazolyl]phenoxy]ethylurea IUPAC Name: 2-[4-[2-(4-methoxyphenyl)-5-methylsulfanylpyrazol-3-yl]phenoxy]ethylurea Traditional Name: 2-[4-[2-(4-methoxyphenyl)-5-(methylthio)pyrazol-3-yl]phenoxy]ethylurea Formula: C20H22N4O3S MolecularWeight: 398.47868

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2C(=CC(=N2)SC)C3=CC=C(C=C3)OCCNC(=O)N

Isomeric SMILES

COC1=CC=C(C=C1)N2C(=CC(=N2)SC)C3=CC=C(C=C3)OCCNC(=O)N

InChI

InChI=1S/C20H22N4O3S/c1-26-16-9-5-15(6-10-16)24-18(13-19(23-24)28-2)14-3-7-17(8-4-14)27-12-11-22-20(21)25/h3-10,13H,11-12H2,1-2H3,(H3,21,22,25)