1-(1,3-benzodioxol-5-yl)-3-(1,3,5-trimethylpyrazol-4-yl)thiourea

Systemtic Name: 1-(1,3-benzodioxol-5-yl)-3-(1,3,5-trimethylpyrazol-4-yl)thiourea Openeye Name: 1-(1,3-benzodioxol-5-yl)-3-(1,3,5-trimethylpyrazol-4-yl)thiourea CAS Name: 1-(1,3-benzodioxol-5-yl)-3-(1,3,5-trimethyl-4-pyrazolyl)thiourea IUPAC Name: 1-(1,3-benzodioxol-5-yl)-3-(1,3,5-trimethylpyrazol-4-yl)thiourea Traditional Name: 1-(1,3-benzodioxol-5-yl)-3-(1,3,5-trimethylpyrazol-4-yl)thiourea Formula: C14H16N4O2S MolecularWeight: 304.36744

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C)C)NC(=S)NC2=CC3=C(C=C2)OCO3

Isomeric SMILES

CC1=C(C(=NN1C)C)NC(=S)NC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C14H16N4O2S/c1-8-13(9(2)18(3)17-8)16-14(21)15-10-4-5-11-12(6-10)20-7-19-11/h4-6H,7H2,1-3H3,(H2,15,16,21)