N-(1,3-benzodioxol-5-ylmethyl)-2-[4-(2,4,6-trimethylphenyl)sulfonylpiperazin-1-yl]propanamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[4-(2,4,6-trimethylphenyl)sulfonylpiperazin-1-yl]propanamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[4-(2,4,6-trimethylphenyl)sulfonylpiperazin-1-yl]propanamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[4-(2,4,6-trimethylphenyl)sulfonyl-1-piperazinyl]propanamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[4-(2,4,6-trimethylphenyl)sulfonylpiperazin-1-yl]propanamide Traditional Name: 2-(4-mesitylsulfonylpiperazino)-N-piperonyl-propionamide Formula: C24H31N3O5S MolecularWeight: 473.58504

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)S(=O)(=O)N2CCN(CC2)C(C)C(=O)NCC3=CC4=C(C=C3)OCO4)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)S(=O)(=O)N2CCN(CC2)C(C)C(=O)NCC3=CC4=C(C=C3)OCO4)C

InChI

InChI=1S/C24H31N3O5S/c1-16-11-17(2)23(18(3)12-16)33(29,30)27-9-7-26(8-10-27)19(4)24(28)25-14-20-5-6-21-22(13-20)32-15-31-21/h5-6,11-13,19H,7-10,14-15H2,1-4H3,(H,25,28)