N-(1,3-benzodioxol-5-ylmethyl)-2-[2-methoxyethyl-(4-methylphenyl)sulfonyl-amino]-N-(thiophen-2-ylmethyl)ethanamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[2-methoxyethyl-(4-methylphenyl)sulfonyl-amino]-N-(thiophen-2-ylmethyl)ethanamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[2-methoxyethyl(p-tolylsulfonyl)amino]-N-(2-thienylmethyl)acetamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[2-methoxyethyl-(4-methylphenyl)sulfonylamino]-N-(thiophen-2-ylmethyl)acetamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[2-methoxyethyl-(4-methylphenyl)sulfonylamino]-N-(thiophen-2-ylmethyl)acetamide Traditional Name: 2-[2-methoxyethyl(tosyl)amino]-N-piperonyl-N-(2-thenyl)acetamide Formula: C25H28N2O6S2 MolecularWeight: 516.62962

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N(CCOC)CC(=O)N(CC2=CC3=C(C=C2)OCO3)CC4=CC=CS4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(CCOC)CC(=O)N(CC2=CC3=C(C=C2)OCO3)CC4=CC=CS4

InChI

InChI=1S/C25H28N2O6S2/c1-19-5-8-22(9-6-19)35(29,30)27(11-12-31-2)17-25(28)26(16-21-4-3-13-34-21)15-20-7-10-23-24(14-20)33-18-32-23/h3-10,13-14H,11-12,15-18H2,1-2H3