N-[2-[1,3-benzodioxol-5-ylmethyl(thiophen-2-ylmethyl)amino]-2-oxidanylidene-ethyl]-4-tert-butyl-N-(oxolan-2-ylmethyl)benzamide

Systemtic Name: N-[2-[1,3-benzodioxol-5-ylmethyl(thiophen-2-ylmethyl)amino]-2-oxidanylidene-ethyl]-4-tert-butyl-N-(oxolan-2-ylmethyl)benzamide Openeye Name: N-[2-[1,3-benzodioxol-5-ylmethyl(2-thienylmethyl)amino]-2-oxo-ethyl]-4-tert-butyl-N-(tetrahydrofuran-2-ylmethyl)benzamide CAS Name: N-[2-[1,3-benzodioxol-5-ylmethyl(thiophen-2-ylmethyl)amino]-2-oxoethyl]-4-tert-butyl-N-(2-oxolanylmethyl)benzamide IUPAC Name: N-[2-[1,3-benzodioxol-5-ylmethyl(thiophen-2-ylmethyl)amino]-2-oxoethyl]-4-tert-butyl-N-(oxolan-2-ylmethyl)benzamide Traditional Name: 4-tert-butyl-N-[2-keto-2-[piperonyl(2-thenyl)amino]ethyl]-N-(tetrahydrofurfuryl)benzamide Formula: C31H36N2O5S MolecularWeight: 548.69294

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)N(CC2CCCO2)CC(=O)N(CC3=CC4=C(C=C3)OCO4)CC5=CC=CS5

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)N(CC2CCCO2)CC(=O)N(CC3=CC4=C(C=C3)OCO4)CC5=CC=CS5

InChI

InChI=1S/C31H36N2O5S/c1-31(2,3)24-11-9-23(10-12-24)30(35)33(18-25-6-4-14-36-25)20-29(34)32(19-26-7-5-15-39-26)17-22-8-13-27-28(16-22)38-21-37-27/h5,7-13,15-16,25H,4,6,14,17-21H2,1-3H3