N-(1,3-benzodioxol-5-ylmethyl)-2-[cyclopropyl(2-phenylmethoxyethanoyl)amino]-N-(thiophen-2-ylmethyl)ethanamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[cyclopropyl(2-phenylmethoxyethanoyl)amino]-N-(thiophen-2-ylmethyl)ethanamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[(2-benzyloxyacetyl)-cyclopropyl-amino]-N-(2-thienylmethyl)acetamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[cyclopropyl-(1-oxo-2-phenylmethoxyethyl)amino]-N-(thiophen-2-ylmethyl)acetamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[cyclopropyl-(2-phenylmethoxyacetyl)amino]-N-(thiophen-2-ylmethyl)acetamide Traditional Name: 2-[(2-benzoxyacetyl)-cyclopropyl-amino]-N-piperonyl-N-(2-thenyl)acetamide Formula: C27H28N2O5S MolecularWeight: 492.58662

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N(CC(=O)N(CC2=CC3=C(C=C2)OCO3)CC4=CC=CS4)C(=O)COCC5=CC=CC=C5

Isomeric SMILES

C1CC1N(CC(=O)N(CC2=CC3=C(C=C2)OCO3)CC4=CC=CS4)C(=O)COCC5=CC=CC=C5

InChI

InChI=1S/C27H28N2O5S/c30-26(16-29(22-9-10-22)27(31)18-32-17-20-5-2-1-3-6-20)28(15-23-7-4-12-35-23)14-21-8-11-24-25(13-21)34-19-33-24/h1-8,11-13,22H,9-10,14-19H2