1-(1,3-benzodioxol-5-yl)-3-(1-ethyl-3-methyl-pyrazol-4-yl)thiourea

Systemtic Name: 1-(1,3-benzodioxol-5-yl)-3-(1-ethyl-3-methyl-pyrazol-4-yl)thiourea Openeye Name: 1-(1,3-benzodioxol-5-yl)-3-(1-ethyl-3-methyl-pyrazol-4-yl)thiourea CAS Name: 1-(1,3-benzodioxol-5-yl)-3-(1-ethyl-3-methyl-4-pyrazolyl)thiourea IUPAC Name: 1-(1,3-benzodioxol-5-yl)-3-(1-ethyl-3-methylpyrazol-4-yl)thiourea Traditional Name: 1-(1,3-benzodioxol-5-yl)-3-(1-ethyl-3-methyl-pyrazol-4-yl)thiourea Formula: C14H16N4O2S MolecularWeight: 304.36744

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=N1)C)NC(=S)NC2=CC3=C(C=C2)OCO3

Isomeric SMILES

CCN1C=C(C(=N1)C)NC(=S)NC2=CC3=C(C=C2)OCO3

InChI

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