2-[1,3-benzodioxol-5-ylmethyl(cyclopentyl)amino]-N-(3-pyrrolidin-1-ylsulfonylphenyl)ethanamide

Systemtic Name: 2-[1,3-benzodioxol-5-ylmethyl(cyclopentyl)amino]-N-(3-pyrrolidin-1-ylsulfonylphenyl)ethanamide Openeye Name: 2-[1,3-benzodioxol-5-ylmethyl(cyclopentyl)amino]-N-(3-pyrrolidin-1-ylsulfonylphenyl)acetamide CAS Name: 2-[1,3-benzodioxol-5-ylmethyl(cyclopentyl)amino]-N-[3-(1-pyrrolidinylsulfonyl)phenyl]acetamide IUPAC Name: 2-[1,3-benzodioxol-5-ylmethyl(cyclopentyl)amino]-N-(3-pyrrolidin-1-ylsulfonylphenyl)acetamide Traditional Name: 2-[cyclopentyl(piperonyl)amino]-N-(3-pyrrolidinosulfonylphenyl)acetamide Formula: C25H31N3O5S MolecularWeight: 485.59574

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)N(CC2=CC3=C(C=C2)OCO3)CC(=O)NC4=CC(=CC=C4)S(=O)(=O)N5CCCC5

Isomeric SMILES

C1CCC(C1)N(CC2=CC3=C(C=C2)OCO3)CC(=O)NC4=CC(=CC=C4)S(=O)(=O)N5CCCC5

InChI

InChI=1S/C25H31N3O5S/c29-25(26-20-6-5-9-22(15-20)34(30,31)28-12-3-4-13-28)17-27(21-7-1-2-8-21)16-19-10-11-23-24(14-19)33-18-32-23/h5-6,9-11,14-15,21H,1-4,7-8,12-13,16-18H2,(H,26,29)