1-(1,3-benzodioxol-5-ylmethyl)-3-[(E)-2,3-dihydroinden-1-ylideneamino]thiourea

Systemtic Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[(E)-2,3-dihydroinden-1-ylideneamino]thiourea Openeye Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[(E)-indan-1-ylideneamino]thiourea CAS Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[(E)-2,3-dihydroinden-1-ylideneamino]thiourea IUPAC Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[(E)-2,3-dihydroinden-1-ylideneamino]thiourea Traditional Name: 1-[(E)-indan-1-ylideneamino]-3-piperonyl-thiourea Formula: C18H17N3O2S MolecularWeight: 339.41148

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=NNC(=S)NCC2=CC3=C(C=C2)OCO3)C4=CC=CC=C41

Isomeric SMILES

C1C/C(=N\NC(=S)NCC2=CC3=C(C=C2)OCO3)/C4=CC=CC=C41

InChI

InChI=1S/C18H17N3O2S/c24-18(19-10-12-5-8-16-17(9-12)23-11-22-16)21-20-15-7-6-13-3-1-2-4-14(13)15/h1-5,8-9H,6-7,10-11H2,(H2,19,21,24)/b20-15+