1-(1,3-benzodioxol-5-yl)-3-(1-methylpyrazol-3-yl)thiourea

Systemtic Name: 1-(1,3-benzodioxol-5-yl)-3-(1-methylpyrazol-3-yl)thiourea Openeye Name: 1-(1,3-benzodioxol-5-yl)-3-(1-methylpyrazol-3-yl)thiourea CAS Name: 1-(1,3-benzodioxol-5-yl)-3-(1-methyl-3-pyrazolyl)thiourea IUPAC Name: 1-(1,3-benzodioxol-5-yl)-3-(1-methylpyrazol-3-yl)thiourea Traditional Name: 1-(1,3-benzodioxol-5-yl)-3-(1-methylpyrazol-3-yl)thiourea Formula: C12H12N4O2S MolecularWeight: 276.31428

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC(=N1)NC(=S)NC2=CC3=C(C=C2)OCO3

Isomeric SMILES

CN1C=CC(=N1)NC(=S)NC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C12H12N4O2S/c1-16-5-4-11(15-16)14-12(19)13-8-2-3-9-10(6-8)18-7-17-9/h2-6H,7H2,1H3,(H2,13,14,15,19)