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

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[tert-butylcarbamoyl(cyclopropyl)amino]-N-(thiophen-2-ylmethyl)ethanamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[tert-butylcarbamoyl(cyclopropyl)amino]-N-(2-thienylmethyl)acetamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[[(tert-butylamino)-oxomethyl]-cyclopropylamino]-N-(thiophen-2-ylmethyl)acetamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[tert-butylcarbamoyl(cyclopropyl)amino]-N-(thiophen-2-ylmethyl)acetamide Traditional Name: 2-[tert-butylcarbamoyl(cyclopropyl)amino]-N-piperonyl-N-(2-thenyl)acetamide Formula: C23H29N3O4S MolecularWeight: 443.55906

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)N(CC(=O)N(CC1=CC2=C(C=C1)OCO2)CC3=CC=CS3)C4CC4

Isomeric SMILES

CC(C)(C)NC(=O)N(CC(=O)N(CC1=CC2=C(C=C1)OCO2)CC3=CC=CS3)C4CC4

InChI

InChI=1S/C23H29N3O4S/c1-23(2,3)24-22(28)26(17-7-8-17)14-21(27)25(13-18-5-4-10-31-18)12-16-6-9-19-20(11-16)30-15-29-19/h4-6,9-11,17H,7-8,12-15H2,1-3H3,(H,24,28)