1-methyl-1-[2-(1,2-oxazol-3-ylmethylsulfanyl)ethyl]thiourea

Systemtic Name: 1-methyl-1-[2-(1,2-oxazol-3-ylmethylsulfanyl)ethyl]thiourea Openeye Name: 1-[2-(isoxazol-3-ylmethylsulfanyl)ethyl]-1-methyl-thiourea CAS Name: 1-[2-(3-isoxazolylmethylthio)ethyl]-1-methylthiourea IUPAC Name: 1-methyl-1-[2-(1,2-oxazol-3-ylmethylsulfanyl)ethyl]thiourea Traditional Name: 1-[2-(isoxazol-3-ylmethylthio)ethyl]-1-methyl-thiourea Formula: C8H13N3OS2 MolecularWeight: 231.33832

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(CCSCC1=NOC=C1)C(=S)N

Isomeric SMILES

CN(CCSCC1=NOC=C1)C(=S)N

InChI

InChI=1S/C8H13N3OS2/c1-11(8(9)13)3-5-14-6-7-2-4-12-10-7/h2,4H,3,5-6H2,1H3,(H2,9,13)