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

Systemtic Name: 3-(1,3-benzodioxol-5-yl)-1-[(1-ethyl-3-methyl-pyrazol-4-yl)methyl]-1-methyl-thiourea Openeye Name: 3-(1,3-benzodioxol-5-yl)-1-[(1-ethyl-3-methyl-pyrazol-4-yl)methyl]-1-methyl-thiourea CAS Name: 3-(1,3-benzodioxol-5-yl)-1-[(1-ethyl-3-methyl-4-pyrazolyl)methyl]-1-methylthiourea IUPAC Name: 3-(1,3-benzodioxol-5-yl)-1-[(1-ethyl-3-methylpyrazol-4-yl)methyl]-1-methylthiourea Traditional Name: 3-(1,3-benzodioxol-5-yl)-1-[(1-ethyl-3-methyl-pyrazol-4-yl)methyl]-1-methyl-thiourea Formula: C16H20N4O2S MolecularWeight: 332.4206

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H20N4O2S/c1-4-20-9-12(11(2)18-20)8-19(3)16(23)17-13-5-6-14-15(7-13)22-10-21-14/h5-7,9H,4,8,10H2,1-3H3,(H,17,23)