1-(1,3-benzodioxol-5-ylmethyl)-3-[(Z)-pyridin-4-ylmethylideneamino]thiourea

Systemtic Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[(Z)-pyridin-4-ylmethylideneamino]thiourea Openeye Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[(Z)-4-pyridylmethyleneamino]thiourea CAS Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[(Z)-pyridin-4-ylmethylideneamino]thiourea IUPAC Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[(Z)-pyridin-4-ylmethylideneamino]thiourea Traditional Name: 1-piperonyl-3-[(Z)-4-pyridylmethyleneamino]thiourea Formula: C15H14N4O2S MolecularWeight: 314.36226

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CNC(=S)NN=CC3=CC=NC=C3

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CNC(=S)N/N=C\C3=CC=NC=C3

InChI

InChI=1S/C15H14N4O2S/c22-15(19-18-9-11-3-5-16-6-4-11)17-8-12-1-2-13-14(7-12)21-10-20-13/h1-7,9H,8,10H2,(H2,17,19,22)/b18-9-