1-oxidanyl-1-(5-phenylsulfanylpent-3-yn-2-yl)urea

Systemtic Name: 1-oxidanyl-1-(5-phenylsulfanylpent-3-yn-2-yl)urea Openeye Name: 1-hydroxy-1-(1-methyl-4-phenylsulfanyl-but-2-ynyl)urea CAS Name: 1-hydroxy-1-[5-(phenylthio)pent-3-yn-2-yl]urea IUPAC Name: 1-hydroxy-1-(5-phenylsulfanylpent-3-yn-2-yl)urea Traditional Name: 1-hydroxy-1-[1-methyl-4-(phenylthio)but-2-ynyl]urea Formula: C12H14N2O2S MolecularWeight: 250.31676

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Descriptors Computed from Structure

Canonical SMILES:

CC(C#CCSC1=CC=CC=C1)N(C(=O)N)O

Isomeric SMILES

CC(C#CCSC1=CC=CC=C1)N(C(=O)N)O

InChI

InChI=1S/C12H14N2O2S/c1-10(14(16)12(13)15)6-5-9-17-11-7-3-2-4-8-11/h2-4,7-8,10,16H,9H2,1H3,(H2,13,15)