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

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[propan-2-yl(quinolin-8-ylsulfonyl)amino]-N-(thiophen-2-ylmethyl)ethanamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[isopropyl(8-quinolylsulfonyl)amino]-N-(2-thienylmethyl)acetamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[propan-2-yl(8-quinolinylsulfonyl)amino]-N-(thiophen-2-ylmethyl)acetamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[propan-2-yl(quinolin-8-ylsulfonyl)amino]-N-(thiophen-2-ylmethyl)acetamide Traditional Name: 2-[isopropyl(8-quinolylsulfonyl)amino]-N-piperonyl-N-(2-thenyl)acetamide Formula: C27H27N3O5S2 MolecularWeight: 537.65038

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(CC(=O)N(CC1=CC2=C(C=C1)OCO2)CC3=CC=CS3)S(=O)(=O)C4=CC=CC5=C4N=CC=C5

Isomeric SMILES

CC(C)N(CC(=O)N(CC1=CC2=C(C=C1)OCO2)CC3=CC=CS3)S(=O)(=O)C4=CC=CC5=C4N=CC=C5

InChI

InChI=1S/C27H27N3O5S2/c1-19(2)30(37(32,33)25-9-3-6-21-7-4-12-28-27(21)25)17-26(31)29(16-22-8-5-13-36-22)15-20-10-11-23-24(14-20)35-18-34-23/h3-14,19H,15-18H2,1-2H3