1-[(E)-1,3-benzodioxol-5-ylmethylideneamino]-3-(1H-indazol-6-yl)thiourea

Systemtic Name: 1-[(E)-1,3-benzodioxol-5-ylmethylideneamino]-3-(1H-indazol-6-yl)thiourea Openeye Name: 1-[(E)-1,3-benzodioxol-5-ylmethyleneamino]-3-(1H-indazol-6-yl)thiourea CAS Name: 1-[(E)-1,3-benzodioxol-5-ylmethylideneamino]-3-(1H-indazol-6-yl)thiourea IUPAC Name: 1-[(E)-1,3-benzodioxol-5-ylmethylideneamino]-3-(1H-indazol-6-yl)thiourea Traditional Name: 1-(1H-indazol-6-yl)-3-[(E)-piperonylideneamino]thiourea Formula: C16H13N5O2S MolecularWeight: 339.37172

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C=NNC(=S)NC3=CC4=C(C=C3)C=NN4

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)/C=N/NC(=S)NC3=CC4=C(C=C3)C=NN4

InChI

InChI=1S/C16H13N5O2S/c24-16(19-12-3-2-11-8-18-20-13(11)6-12)21-17-7-10-1-4-14-15(5-10)23-9-22-14/h1-8H,9H2,(H,18,20)(H2,19,21,24)/b17-7+