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

Systemtic Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[(Z)-(2,5-dimethylphenyl)methylideneamino]thiourea Openeye Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[(Z)-(2,5-dimethylphenyl)methyleneamino]thiourea CAS Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[(Z)-(2,5-dimethylphenyl)methylideneamino]thiourea IUPAC Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[(Z)-(2,5-dimethylphenyl)methylideneamino]thiourea Traditional Name: 1-[(Z)-(2,5-dimethylbenzylidene)amino]-3-piperonyl-thiourea Formula: C18H19N3O2S MolecularWeight: 341.42736

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)C=NNC(=S)NCC2=CC3=C(C=C2)OCO3

Isomeric SMILES

CC1=CC(=C(C=C1)C)/C=N\NC(=S)NCC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C18H19N3O2S/c1-12-3-4-13(2)15(7-12)10-20-21-18(24)19-9-14-5-6-16-17(8-14)23-11-22-16/h3-8,10H,9,11H2,1-2H3,(H2,19,21,24)/b20-10-