1-(1,3-benzodioxol-5-ylmethyl)-3-[(Z)-(3-fluorophenyl)methylideneamino]thiourea

Systemtic Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[(Z)-(3-fluorophenyl)methylideneamino]thiourea Openeye Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[(Z)-(3-fluorophenyl)methyleneamino]thiourea CAS Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[(Z)-(3-fluorophenyl)methylideneamino]thiourea IUPAC Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[(Z)-(3-fluorophenyl)methylideneamino]thiourea Traditional Name: 1-[(Z)-(3-fluorobenzylidene)amino]-3-piperonyl-thiourea Formula: C16H14FN3O2S MolecularWeight: 331.364663

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H14FN3O2S/c17-13-3-1-2-11(6-13)9-19-20-16(23)18-8-12-4-5-14-15(7-12)22-10-21-14/h1-7,9H,8,10H2,(H2,18,20,23)/b19-9-