1-[(E)-1-(1,3-benzodioxol-5-yl)ethylideneamino]-3-(3,4-dimethoxyphenyl)thiourea

Systemtic Name: 1-[(E)-1-(1,3-benzodioxol-5-yl)ethylideneamino]-3-(3,4-dimethoxyphenyl)thiourea Openeye Name: 1-[(E)-1-(1,3-benzodioxol-5-yl)ethylideneamino]-3-(3,4-dimethoxyphenyl)thiourea CAS Name: 1-[(E)-1-(1,3-benzodioxol-5-yl)ethylideneamino]-3-(3,4-dimethoxyphenyl)thiourea IUPAC Name: 1-[(E)-1-(1,3-benzodioxol-5-yl)ethylideneamino]-3-(3,4-dimethoxyphenyl)thiourea Traditional Name: 1-[(E)-1-(1,3-benzodioxol-5-yl)ethylideneamino]-3-(3,4-dimethoxyphenyl)thiourea Formula: C18H19N3O4S MolecularWeight: 373.42616

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=S)NC1=CC(=C(C=C1)OC)OC)C2=CC3=C(C=C2)OCO3

Isomeric SMILES

C/C(=N\NC(=S)NC1=CC(=C(C=C1)OC)OC)/C2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C18H19N3O4S/c1-11(12-4-6-15-17(8-12)25-10-24-15)20-21-18(26)19-13-5-7-14(22-2)16(9-13)23-3/h4-9H,10H2,1-3H3,(H2,19,21,26)/b20-11+