N-(1,3-benzodioxol-5-ylmethyl)-2-[(4-bromophenyl)sulfonyl-cyclohexyl-amino]ethanamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[(4-bromophenyl)sulfonyl-cyclohexyl-amino]ethanamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[(4-bromophenyl)sulfonyl-cyclohexyl-amino]acetamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[(4-bromophenyl)sulfonyl-cyclohexylamino]acetamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[(4-bromophenyl)sulfonyl-cyclohexylamino]acetamide Traditional Name: 2-[brosyl(cyclohexyl)amino]-N-piperonyl-acetamide Formula: C22H25BrN2O5S MolecularWeight: 509.4133

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N(CC(=O)NCC2=CC3=C(C=C2)OCO3)S(=O)(=O)C4=CC=C(C=C4)Br

Isomeric SMILES

C1CCC(CC1)N(CC(=O)NCC2=CC3=C(C=C2)OCO3)S(=O)(=O)C4=CC=C(C=C4)Br

InChI

InChI=1S/C22H25BrN2O5S/c23-17-7-9-19(10-8-17)31(27,28)25(18-4-2-1-3-5-18)14-22(26)24-13-16-6-11-20-21(12-16)30-15-29-20/h6-12,18H,1-5,13-15H2,(H,24,26)