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

Systemtic Name: 1-[(E)-1,3-benzodioxol-5-ylmethylideneamino]-3-pyridin-3-yl-thiourea Openeye Name: 1-[(E)-1,3-benzodioxol-5-ylmethyleneamino]-3-(3-pyridyl)thiourea CAS Name: 1-[(E)-1,3-benzodioxol-5-ylmethylideneamino]-3-(3-pyridinyl)thiourea IUPAC Name: 1-[(E)-1,3-benzodioxol-5-ylmethylideneamino]-3-pyridin-3-ylthiourea Traditional Name: 1-[(E)-piperonylideneamino]-3-(3-pyridyl)thiourea Formula: C14H12N4O2S MolecularWeight: 300.33568

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C=NNC(=S)NC3=CN=CC=C3

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)/C=N/NC(=S)NC3=CN=CC=C3

InChI

InChI=1S/C14H12N4O2S/c21-14(17-11-2-1-5-15-8-11)18-16-7-10-3-4-12-13(6-10)20-9-19-12/h1-8H,9H2,(H2,17,18,21)/b16-7+