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

Systemtic Name: N-[2-[1,3-benzodioxol-5-ylmethyl(thiophen-2-ylmethyl)amino]-2-oxidanylidene-ethyl]-N-(2-methoxyethyl)-4-pentyl-benzamide Openeye Name: N-[2-[1,3-benzodioxol-5-ylmethyl(2-thienylmethyl)amino]-2-oxo-ethyl]-N-(2-methoxyethyl)-4-pentyl-benzamide CAS Name: N-[2-[1,3-benzodioxol-5-ylmethyl(thiophen-2-ylmethyl)amino]-2-oxoethyl]-N-(2-methoxyethyl)-4-pentylbenzamide IUPAC Name: N-[2-[1,3-benzodioxol-5-ylmethyl(thiophen-2-ylmethyl)amino]-2-oxoethyl]-N-(2-methoxyethyl)-4-pentylbenzamide Traditional Name: 4-amyl-N-[2-keto-2-[piperonyl(2-thenyl)amino]ethyl]-N-(2-methoxyethyl)benzamide Formula: C30H36N2O5S MolecularWeight: 536.68224

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC=C(C=C1)C(=O)N(CCOC)CC(=O)N(CC2=CC3=C(C=C2)OCO3)CC4=CC=CS4

Isomeric SMILES

CCCCCC1=CC=C(C=C1)C(=O)N(CCOC)CC(=O)N(CC2=CC3=C(C=C2)OCO3)CC4=CC=CS4

InChI

InChI=1S/C30H36N2O5S/c1-3-4-5-7-23-9-12-25(13-10-23)30(34)31(15-16-35-2)21-29(33)32(20-26-8-6-17-38-26)19-24-11-14-27-28(18-24)37-22-36-27/h6,8-14,17-18H,3-5,7,15-16,19-22H2,1-2H3