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

Systemtic Name: 1-[(E)-1,3-benzodioxol-5-ylmethylideneamino]-3-ethyl-thiourea Openeye Name: 1-[(E)-1,3-benzodioxol-5-ylmethyleneamino]-3-ethyl-thiourea CAS Name: 1-[(E)-1,3-benzodioxol-5-ylmethylideneamino]-3-ethylthiourea IUPAC Name: 1-[(E)-1,3-benzodioxol-5-ylmethylideneamino]-3-ethylthiourea Traditional Name: 1-ethyl-3-[(E)-piperonylideneamino]thiourea Formula: C11H13N3O2S MolecularWeight: 251.30482

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H13N3O2S/c1-2-12-11(17)14-13-6-8-3-4-9-10(5-8)16-7-15-9/h3-6H,2,7H2,1H3,(H2,12,14,17)/b13-6+