1-(1,3-benzodioxol-5-yl)-3-[2-(3,4-dimethoxyphenyl)ethyl]-1-ethyl-thiourea

Systemtic Name: 1-(1,3-benzodioxol-5-yl)-3-[2-(3,4-dimethoxyphenyl)ethyl]-1-ethyl-thiourea Openeye Name: 1-(1,3-benzodioxol-5-yl)-3-[2-(3,4-dimethoxyphenyl)ethyl]-1-ethyl-thiourea CAS Name: 1-(1,3-benzodioxol-5-yl)-3-[2-(3,4-dimethoxyphenyl)ethyl]-1-ethylthiourea IUPAC Name: 1-(1,3-benzodioxol-5-yl)-3-[2-(3,4-dimethoxyphenyl)ethyl]-1-ethylthiourea Traditional Name: 1-(1,3-benzodioxol-5-yl)-1-ethyl-3-homoveratryl-thiourea Formula: C20H24N2O4S MolecularWeight: 388.48056

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=CC2=C(C=C1)OCO2)C(=S)NCCC3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CCN(C1=CC2=C(C=C1)OCO2)C(=S)NCCC3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C20H24N2O4S/c1-4-22(15-6-8-17-19(12-15)26-13-25-17)20(27)21-10-9-14-5-7-16(23-2)18(11-14)24-3/h5-8,11-12H,4,9-10,13H2,1-3H3,(H,21,27)