1-(1,3-benzodioxol-5-ylmethyl)-3-[(Z)-(3-ethoxy-4-methoxy-phenyl)methylideneamino]thiourea

Systemtic Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[(Z)-(3-ethoxy-4-methoxy-phenyl)methylideneamino]thiourea Openeye Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[(Z)-(3-ethoxy-4-methoxy-phenyl)methyleneamino]thiourea CAS Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[(Z)-(3-ethoxy-4-methoxyphenyl)methylideneamino]thiourea IUPAC Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[(Z)-(3-ethoxy-4-methoxyphenyl)methylideneamino]thiourea Traditional Name: 1-[(Z)-(3-ethoxy-4-methoxy-benzylidene)amino]-3-piperonyl-thiourea Formula: C19H21N3O4S MolecularWeight: 387.45274

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C=NNC(=S)NCC2=CC3=C(C=C2)OCO3)OC

Isomeric SMILES

CCOC1=C(C=CC(=C1)/C=N\NC(=S)NCC2=CC3=C(C=C2)OCO3)OC

InChI

InChI=1S/C19H21N3O4S/c1-3-24-17-9-14(4-6-15(17)23-2)11-21-22-19(27)20-10-13-5-7-16-18(8-13)26-12-25-16/h4-9,11H,3,10,12H2,1-2H3,(H2,20,22,27)/b21-11-