1-(1,3-benzodioxol-5-ylmethyl)-3-[(Z)-(5-methylfuran-2-yl)methylideneamino]thiourea

Systemtic Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[(Z)-(5-methylfuran-2-yl)methylideneamino]thiourea Openeye Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[(Z)-(5-methyl-2-furyl)methyleneamino]thiourea CAS Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[(Z)-(5-methyl-2-furanyl)methylideneamino]thiourea IUPAC Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[(Z)-(5-methylfuran-2-yl)methylideneamino]thiourea Traditional Name: 1-[(Z)-(5-methyl-2-furyl)methyleneamino]-3-piperonyl-thiourea Formula: C15H15N3O3S MolecularWeight: 317.3629

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(O1)C=NNC(=S)NCC2=CC3=C(C=C2)OCO3

Isomeric SMILES

CC1=CC=C(O1)/C=N\NC(=S)NCC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C15H15N3O3S/c1-10-2-4-12(21-10)8-17-18-15(22)16-7-11-3-5-13-14(6-11)20-9-19-13/h2-6,8H,7,9H2,1H3,(H2,16,18,22)/b17-8-