N-[2-[2-(3,4-dimethoxyphenyl)ethyl-[(3-methylthiophen-2-yl)methyl]amino]-2-oxidanylidene-ethyl]-N-(2-methylpropyl)-1,3-benzodioxole-5-carboxamide

Systemtic Name: N-[2-[2-(3,4-dimethoxyphenyl)ethyl-[(3-methylthiophen-2-yl)methyl]amino]-2-oxidanylidene-ethyl]-N-(2-methylpropyl)-1,3-benzodioxole-5-carboxamide Openeye Name: N-[2-[2-(3,4-dimethoxyphenyl)ethyl-[(3-methyl-2-thienyl)methyl]amino]-2-oxo-ethyl]-N-isobutyl-1,3-benzodioxole-5-carboxamide CAS Name: N-[2-[2-(3,4-dimethoxyphenyl)ethyl-[(3-methyl-2-thiophenyl)methyl]amino]-2-oxoethyl]-N-(2-methylpropyl)-1,3-benzodioxole-5-carboxamide IUPAC Name: N-[2-[2-(3,4-dimethoxyphenyl)ethyl-[(3-methylthiophen-2-yl)methyl]amino]-2-oxoethyl]-N-(2-methylpropyl)-1,3-benzodioxole-5-carboxamide Traditional Name: N-[2-[homoveratryl-[(3-methyl-2-thienyl)methyl]amino]-2-keto-ethyl]-N-isobutyl-piperonylamide Formula: C30H36N2O6S MolecularWeight: 552.68164

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC=C1)CN(CCC2=CC(=C(C=C2)OC)OC)C(=O)CN(CC(C)C)C(=O)C3=CC4=C(C=C3)OCO4

Isomeric SMILES

CC1=C(SC=C1)CN(CCC2=CC(=C(C=C2)OC)OC)C(=O)CN(CC(C)C)C(=O)C3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C30H36N2O6S/c1-20(2)16-32(30(34)23-7-9-25-27(15-23)38-19-37-25)18-29(33)31(17-28-21(3)11-13-39-28)12-10-22-6-8-24(35-4)26(14-22)36-5/h6-9,11,13-15,20H,10,12,16-19H2,1-5H3