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

Systemtic Name: N-[2-[1,3-benzodioxol-5-ylmethyl(thiophen-2-ylmethyl)amino]-2-oxidanylidene-ethyl]-4-ethyl-N-(2-methylpropyl)benzamide Openeye Name: N-[2-[1,3-benzodioxol-5-ylmethyl(2-thienylmethyl)amino]-2-oxo-ethyl]-4-ethyl-N-isobutyl-benzamide CAS Name: N-[2-[1,3-benzodioxol-5-ylmethyl(thiophen-2-ylmethyl)amino]-2-oxoethyl]-4-ethyl-N-(2-methylpropyl)benzamide IUPAC Name: N-[2-[1,3-benzodioxol-5-ylmethyl(thiophen-2-ylmethyl)amino]-2-oxoethyl]-4-ethyl-N-(2-methylpropyl)benzamide Traditional Name: 4-ethyl-N-isobutyl-N-[2-keto-2-[piperonyl(2-thenyl)amino]ethyl]benzamide Formula: C28H32N2O4S MolecularWeight: 492.62968

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(=O)N(CC(C)C)CC(=O)N(CC2=CC3=C(C=C2)OCO3)CC4=CC=CS4

Isomeric SMILES

CCC1=CC=C(C=C1)C(=O)N(CC(C)C)CC(=O)N(CC2=CC3=C(C=C2)OCO3)CC4=CC=CS4

InChI

InChI=1S/C28H32N2O4S/c1-4-21-7-10-23(11-8-21)28(32)30(15-20(2)3)18-27(31)29(17-24-6-5-13-35-24)16-22-9-12-25-26(14-22)34-19-33-25/h5-14,20H,4,15-19H2,1-3H3