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

Systemtic Name: N-[2-[1,3-benzodioxol-5-ylmethyl(thiophen-2-ylmethyl)amino]-2-oxidanylidene-ethyl]-3-cyclopentyl-N-cyclopropyl-propanamide Openeye Name: N-[2-[1,3-benzodioxol-5-ylmethyl(2-thienylmethyl)amino]-2-oxo-ethyl]-3-cyclopentyl-N-cyclopropyl-propanamide CAS Name: N-[2-[1,3-benzodioxol-5-ylmethyl(thiophen-2-ylmethyl)amino]-2-oxoethyl]-3-cyclopentyl-N-cyclopropylpropanamide IUPAC Name: N-[2-[1,3-benzodioxol-5-ylmethyl(thiophen-2-ylmethyl)amino]-2-oxoethyl]-3-cyclopentyl-N-cyclopropylpropanamide Traditional Name: 3-cyclopentyl-N-cyclopropyl-N-[2-keto-2-[piperonyl(2-thenyl)amino]ethyl]propionamide Formula: C26H32N2O4S MolecularWeight: 468.60828

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)CCC(=O)N(CC(=O)N(CC2=CC3=C(C=C2)OCO3)CC4=CC=CS4)C5CC5

Isomeric SMILES

C1CCC(C1)CCC(=O)N(CC(=O)N(CC2=CC3=C(C=C2)OCO3)CC4=CC=CS4)C5CC5

InChI

InChI=1S/C26H32N2O4S/c29-25(12-8-19-4-1-2-5-19)28(21-9-10-21)17-26(30)27(16-22-6-3-13-33-22)15-20-7-11-23-24(14-20)32-18-31-23/h3,6-7,11,13-14,19,21H,1-2,4-5,8-10,12,15-18H2