N-(1,3-benzodioxol-5-ylmethyl)-2-[oxolan-2-ylmethyl(quinolin-8-ylsulfonyl)amino]-N-(thiophen-2-ylmethyl)ethanamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[oxolan-2-ylmethyl(quinolin-8-ylsulfonyl)amino]-N-(thiophen-2-ylmethyl)ethanamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[8-quinolylsulfonyl(tetrahydrofuran-2-ylmethyl)amino]-N-(2-thienylmethyl)acetamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[2-oxolanylmethyl(8-quinolinylsulfonyl)amino]-N-(thiophen-2-ylmethyl)acetamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[oxolan-2-ylmethyl(quinolin-8-ylsulfonyl)amino]-N-(thiophen-2-ylmethyl)acetamide Traditional Name: N-piperonyl-2-[8-quinolylsulfonyl(tetrahydrofurfuryl)amino]-N-(2-thenyl)acetamide Formula: C29H29N3O6S2 MolecularWeight: 579.68706

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)CN(CC(=O)N(CC2=CC3=C(C=C2)OCO3)CC4=CC=CS4)S(=O)(=O)C5=CC=CC6=C5N=CC=C6

Isomeric SMILES

C1CC(OC1)CN(CC(=O)N(CC2=CC3=C(C=C2)OCO3)CC4=CC=CS4)S(=O)(=O)C5=CC=CC6=C5N=CC=C6

InChI

InChI=1S/C29H29N3O6S2/c33-28(31(18-24-8-4-14-39-24)16-21-10-11-25-26(15-21)38-20-37-25)19-32(17-23-7-3-13-36-23)40(34,35)27-9-1-5-22-6-2-12-30-29(22)27/h1-2,4-6,8-12,14-15,23H,3,7,13,16-20H2