1-tert-butyl-3-[5-[(E)-2-oxidanyl-4-oxidanylidene-pent-2-en-3-yl]sulfanyl-1,3,4-thiadiazol-2-yl]urea

Systemtic Name: 1-tert-butyl-3-[5-[(E)-2-oxidanyl-4-oxidanylidene-pent-2-en-3-yl]sulfanyl-1,3,4-thiadiazol-2-yl]urea Openeye Name: 1-[5-[(E)-1-acetyl-2-hydroxy-prop-1-enyl]sulfanyl-1,3,4-thiadiazol-2-yl]-3-tert-butyl-urea CAS Name: 1-tert-butyl-3-[5-[[(E)-2-hydroxy-4-oxopent-2-en-3-yl]thio]-1,3,4-thiadiazol-2-yl]urea IUPAC Name: 1-tert-butyl-3-[5-[(E)-2-hydroxy-4-oxopent-2-en-3-yl]sulfanyl-1,3,4-thiadiazol-2-yl]urea Traditional Name: 1-[5-[[(E)-1-acetyl-2-hydroxy-prop-1-enyl]thio]-1,3,4-thiadiazol-2-yl]-3-tert-butyl-urea Formula: C12H18N4O3S2 MolecularWeight: 330.42632

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=C(C(=O)C)SC1=NN=C(S1)NC(=O)NC(C)(C)C)O

Isomeric SMILES

C/C(=C(/C(=O)C)\SC1=NN=C(S1)NC(=O)NC(C)(C)C)/O

InChI

InChI=1S/C12H18N4O3S2/c1-6(17)8(7(2)18)20-11-16-15-10(21-11)13-9(19)14-12(3,4)5/h17H,1-5H3,(H2,13,14,15,19)/b8-6+