1-(1,3-benzodioxol-5-ylmethyl)-3-[(Z)-1-(2,3-dihydro-1H-inden-5-yl)ethylideneamino]thiourea

Systemtic Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[(Z)-1-(2,3-dihydro-1H-inden-5-yl)ethylideneamino]thiourea Openeye Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[(Z)-1-indan-5-ylethylideneamino]thiourea CAS Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[(Z)-1-(2,3-dihydro-1H-inden-5-yl)ethylideneamino]thiourea IUPAC Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[(Z)-1-(2,3-dihydro-1H-inden-5-yl)ethylideneamino]thiourea Traditional Name: 1-[(Z)-1-indan-5-ylethylideneamino]-3-piperonyl-thiourea Formula: C20H21N3O2S MolecularWeight: 367.46464

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=S)NCC1=CC2=C(C=C1)OCO2)C3=CC4=C(CCC4)C=C3

Isomeric SMILES

C/C(=N/NC(=S)NCC1=CC2=C(C=C1)OCO2)/C3=CC4=C(CCC4)C=C3

InChI

InChI=1S/C20H21N3O2S/c1-13(16-7-6-15-3-2-4-17(15)10-16)22-23-20(26)21-11-14-5-8-18-19(9-14)25-12-24-18/h5-10H,2-4,11-12H2,1H3,(H2,21,23,26)/b22-13-