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

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[cyclopropyl(quinolin-8-ylsulfonyl)amino]-N-(thiophen-2-ylmethyl)ethanamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[cyclopropyl(8-quinolylsulfonyl)amino]-N-(2-thienylmethyl)acetamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[cyclopropyl(8-quinolinylsulfonyl)amino]-N-(thiophen-2-ylmethyl)acetamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[cyclopropyl(quinolin-8-ylsulfonyl)amino]-N-(thiophen-2-ylmethyl)acetamide Traditional Name: 2-[cyclopropyl(8-quinolylsulfonyl)amino]-N-piperonyl-N-(2-thenyl)acetamide Formula: C27H25N3O5S2 MolecularWeight: 535.6345

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N(CC(=O)N(CC2=CC3=C(C=C2)OCO3)CC4=CC=CS4)S(=O)(=O)C5=CC=CC6=C5N=CC=C6

Isomeric SMILES

C1CC1N(CC(=O)N(CC2=CC3=C(C=C2)OCO3)CC4=CC=CS4)S(=O)(=O)C5=CC=CC6=C5N=CC=C6

InChI

InChI=1S/C27H25N3O5S2/c31-26(29(16-22-6-3-13-36-22)15-19-8-11-23-24(14-19)35-18-34-23)17-30(21-9-10-21)37(32,33)25-7-1-4-20-5-2-12-28-27(20)25/h1-8,11-14,21H,9-10,15-18H2