N-[2-[1,3-benzodioxol-5-ylmethyl(thiophen-2-ylmethyl)amino]-2-oxidanylidene-ethyl]-3-cyclopentyl-N-(3-methoxypropyl)propanamide

Systemtic Name: N-[2-[1,3-benzodioxol-5-ylmethyl(thiophen-2-ylmethyl)amino]-2-oxidanylidene-ethyl]-3-cyclopentyl-N-(3-methoxypropyl)propanamide Openeye Name: N-[2-[1,3-benzodioxol-5-ylmethyl(2-thienylmethyl)amino]-2-oxo-ethyl]-3-cyclopentyl-N-(3-methoxypropyl)propanamide CAS Name: N-[2-[1,3-benzodioxol-5-ylmethyl(thiophen-2-ylmethyl)amino]-2-oxoethyl]-3-cyclopentyl-N-(3-methoxypropyl)propanamide IUPAC Name: N-[2-[1,3-benzodioxol-5-ylmethyl(thiophen-2-ylmethyl)amino]-2-oxoethyl]-3-cyclopentyl-N-(3-methoxypropyl)propanamide Traditional Name: 3-cyclopentyl-N-[2-keto-2-[piperonyl(2-thenyl)amino]ethyl]-N-(3-methoxypropyl)propionamide Formula: C27H36N2O5S MolecularWeight: 500.65014

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Descriptors Computed from Structure

Canonical SMILES:

COCCCN(CC(=O)N(CC1=CC2=C(C=C1)OCO2)CC3=CC=CS3)C(=O)CCC4CCCC4

Isomeric SMILES

COCCCN(CC(=O)N(CC1=CC2=C(C=C1)OCO2)CC3=CC=CS3)C(=O)CCC4CCCC4

InChI

InChI=1S/C27H36N2O5S/c1-32-14-5-13-28(26(30)12-10-21-6-2-3-7-21)19-27(31)29(18-23-8-4-15-35-23)17-22-9-11-24-25(16-22)34-20-33-24/h4,8-9,11,15-16,21H,2-3,5-7,10,12-14,17-20H2,1H3