N-[2-[1,3-benzodioxol-5-ylmethyl(thiophen-2-ylmethyl)amino]-2-oxidanylidene-ethyl]-N-cyclopropyl-2-ethyl-hexanamide

Systemtic Name: N-[2-[1,3-benzodioxol-5-ylmethyl(thiophen-2-ylmethyl)amino]-2-oxidanylidene-ethyl]-N-cyclopropyl-2-ethyl-hexanamide Openeye Name: N-[2-[1,3-benzodioxol-5-ylmethyl(2-thienylmethyl)amino]-2-oxo-ethyl]-N-cyclopropyl-2-ethyl-hexanamide CAS Name: N-[2-[1,3-benzodioxol-5-ylmethyl(thiophen-2-ylmethyl)amino]-2-oxoethyl]-N-cyclopropyl-2-ethylhexanamide IUPAC Name: N-[2-[1,3-benzodioxol-5-ylmethyl(thiophen-2-ylmethyl)amino]-2-oxoethyl]-N-cyclopropyl-2-ethylhexanamide Traditional Name: N-cyclopropyl-2-ethyl-N-[2-keto-2-[piperonyl(2-thenyl)amino]ethyl]hexanamide Formula: C26H34N2O4S MolecularWeight: 470.62416

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)C(=O)N(CC(=O)N(CC1=CC2=C(C=C1)OCO2)CC3=CC=CS3)C4CC4

Isomeric SMILES

CCCCC(CC)C(=O)N(CC(=O)N(CC1=CC2=C(C=C1)OCO2)CC3=CC=CS3)C4CC4

InChI

InChI=1S/C26H34N2O4S/c1-3-5-7-20(4-2)26(30)28(21-10-11-21)17-25(29)27(16-22-8-6-13-33-22)15-19-9-12-23-24(14-19)32-18-31-23/h6,8-9,12-14,20-21H,3-5,7,10-11,15-18H2,1-2H3