1-[4-[3-(4-methylsulfanylphenoxy)phenyl]but-3-yn-2-yl]-1-oxidanyl-urea

Systemtic Name: 1-[4-[3-(4-methylsulfanylphenoxy)phenyl]but-3-yn-2-yl]-1-oxidanyl-urea Openeye Name: 1-hydroxy-1-[1-methyl-3-[3-(4-methylsulfanylphenoxy)phenyl]prop-2-ynyl]urea CAS Name: 1-hydroxy-1-[4-[3-[4-(methylthio)phenoxy]phenyl]but-3-yn-2-yl]urea IUPAC Name: 1-hydroxy-1-[4-[3-(4-methylsulfanylphenoxy)phenyl]but-3-yn-2-yl]urea Traditional Name: 1-hydroxy-1-[1-methyl-3-[3-[4-(methylthio)phenoxy]phenyl]prop-2-ynyl]urea Formula: C18H18N2O3S MolecularWeight: 342.41212

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Descriptors Computed from Structure

Canonical SMILES:

CC(C#CC1=CC(=CC=C1)OC2=CC=C(C=C2)SC)N(C(=O)N)O

Isomeric SMILES

CC(C#CC1=CC(=CC=C1)OC2=CC=C(C=C2)SC)N(C(=O)N)O

InChI

InChI=1S/C18H18N2O3S/c1-13(20(22)18(19)21)6-7-14-4-3-5-16(12-14)23-15-8-10-17(24-2)11-9-15/h3-5,8-13,22H,1-2H3,(H2,19,21)