1-[(E)-3-(2-but-2-ynylsulfanylphenyl)prop-2-enyl]-1-oxidanyl-urea

Systemtic Name: 1-[(E)-3-(2-but-2-ynylsulfanylphenyl)prop-2-enyl]-1-oxidanyl-urea Openeye Name: 1-[(E)-3-(2-but-2-ynylsulfanylphenyl)allyl]-1-hydroxy-urea CAS Name: 1-[(E)-3-[2-(but-2-ynylthio)phenyl]prop-2-enyl]-1-hydroxyurea IUPAC Name: 1-[(E)-3-(2-but-2-ynylsulfanylphenyl)prop-2-enyl]-1-hydroxyurea Traditional Name: 1-[(E)-3-[2-(but-2-ynylthio)phenyl]allyl]-1-hydroxy-urea Formula: C14H16N2O2S MolecularWeight: 276.35404

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC#CCSC1=CC=CC=C1C=CCN(C(=O)N)O

Isomeric SMILES

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

InChI

InChI=1S/C14H16N2O2S/c1-2-3-11-19-13-9-5-4-7-12(13)8-6-10-16(18)14(15)17/h4-9,18H,10-11H2,1H3,(H2,15,17)/b8-6+