1-(1,3-benzodioxol-5-ylmethyl)-3-[(Z)-(7-methoxy-1,3-benzodioxol-5-yl)methylideneamino]thiourea

Systemtic Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[(Z)-(7-methoxy-1,3-benzodioxol-5-yl)methylideneamino]thiourea Openeye Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[(Z)-(7-methoxy-1,3-benzodioxol-5-yl)methyleneamino]thiourea CAS Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[(Z)-(7-methoxy-1,3-benzodioxol-5-yl)methylideneamino]thiourea IUPAC Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[(Z)-(7-methoxy-1,3-benzodioxol-5-yl)methylideneamino]thiourea Traditional Name: 1-[(Z)-(7-methoxy-1,3-benzodioxol-5-yl)methyleneamino]-3-piperonyl-thiourea Formula: C18H17N3O5S MolecularWeight: 387.40968

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC2=C1OCO2)C=NNC(=S)NCC3=CC4=C(C=C3)OCO4

Isomeric SMILES

COC1=CC(=CC2=C1OCO2)/C=N\NC(=S)NCC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C18H17N3O5S/c1-22-15-5-12(6-16-17(15)26-10-25-16)8-20-21-18(27)19-7-11-2-3-13-14(4-11)24-9-23-13/h2-6,8H,7,9-10H2,1H3,(H2,19,21,27)/b20-8-