N-(1,3-benzodioxol-5-ylmethyl)-2-[2-methylpropyl(phenylsulfonyl)amino]-N-[(3-methylthiophen-2-yl)methyl]ethanamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[2-methylpropyl(phenylsulfonyl)amino]-N-[(3-methylthiophen-2-yl)methyl]ethanamide Openeye Name: 2-[benzenesulfonyl(isobutyl)amino]-N-(1,3-benzodioxol-5-ylmethyl)-N-[(3-methyl-2-thienyl)methyl]acetamide CAS Name: 2-[benzenesulfonyl(2-methylpropyl)amino]-N-(1,3-benzodioxol-5-ylmethyl)-N-[(3-methyl-2-thiophenyl)methyl]acetamide IUPAC Name: 2-[benzenesulfonyl(2-methylpropyl)amino]-N-(1,3-benzodioxol-5-ylmethyl)-N-[(3-methylthiophen-2-yl)methyl]acetamide Traditional Name: 2-[besyl(isobutyl)amino]-N-[(3-methyl-2-thienyl)methyl]-N-piperonyl-acetamide Formula: C26H30N2O5S2 MolecularWeight: 514.6568

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC=C1)CN(CC2=CC3=C(C=C2)OCO3)C(=O)CN(CC(C)C)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

CC1=C(SC=C1)CN(CC2=CC3=C(C=C2)OCO3)C(=O)CN(CC(C)C)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C26H30N2O5S2/c1-19(2)14-28(35(30,31)22-7-5-4-6-8-22)17-26(29)27(16-25-20(3)11-12-34-25)15-21-9-10-23-24(13-21)33-18-32-23/h4-13,19H,14-18H2,1-3H3