1-(1-benzo[f][1,3]benzodioxol-6-ylethylideneamino)thiourea

Systemtic Name: 1-(1-benzo[f][1,3]benzodioxol-6-ylethylideneamino)thiourea Openeye Name: (1-benzo[f][1,3]benzodioxol-6-ylethylideneamino)thiourea CAS Name: [1-(6-benzo[f][1,3]benzodioxolyl)ethylideneamino]thiourea IUPAC Name: (1-benzo[f][1,3]benzodioxol-6-ylethylideneamino)thiourea Traditional Name: (1-benzo[f][1,3]benzodioxol-6-ylethylideneamino)thiourea Formula: C14H13N3O2S MolecularWeight: 287.33692

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=S)N)C1=CC2=CC3=C(C=C2C=C1)OCO3

Isomeric SMILES

CC(=NNC(=S)N)C1=CC2=CC3=C(C=C2C=C1)OCO3

InChI

InChI=1S/C14H13N3O2S/c1-8(16-17-14(15)20)9-2-3-10-5-12-13(19-7-18-12)6-11(10)4-9/h2-6H,7H2,1H3,(H3,15,17,20)