1-[(E)-1,3-benzodioxol-5-ylmethylideneamino]-3-methyl-thiourea

Systemtic Name: 1-[(E)-1,3-benzodioxol-5-ylmethylideneamino]-3-methyl-thiourea Openeye Name: 1-[(E)-1,3-benzodioxol-5-ylmethyleneamino]-3-methyl-thiourea CAS Name: 1-[(E)-1,3-benzodioxol-5-ylmethylideneamino]-3-methylthiourea IUPAC Name: 1-[(E)-1,3-benzodioxol-5-ylmethylideneamino]-3-methylthiourea Traditional Name: 1-methyl-3-[(E)-piperonylideneamino]thiourea Formula: C10H11N3O2S MolecularWeight: 237.27824

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=S)NN=CC1=CC2=C(C=C1)OCO2

Isomeric SMILES

CNC(=S)N/N=C/C1=CC2=C(C=C1)OCO2

InChI

InChI=1S/C10H11N3O2S/c1-11-10(16)13-12-5-7-2-3-8-9(4-7)15-6-14-8/h2-5H,6H2,1H3,(H2,11,13,16)/b12-5+