N-(1,3-benzodioxol-5-yl)-2-[4-(2,4-dimethylphenyl)sulfonylpiperazin-1-yl]ethanamide

Systemtic Name: N-(1,3-benzodioxol-5-yl)-2-[4-(2,4-dimethylphenyl)sulfonylpiperazin-1-yl]ethanamide Openeye Name: N-(1,3-benzodioxol-5-yl)-2-[4-(2,4-dimethylphenyl)sulfonylpiperazin-1-yl]acetamide CAS Name: N-(1,3-benzodioxol-5-yl)-2-[4-(2,4-dimethylphenyl)sulfonyl-1-piperazinyl]acetamide IUPAC Name: N-(1,3-benzodioxol-5-yl)-2-[4-(2,4-dimethylphenyl)sulfonylpiperazin-1-yl]acetamide Traditional Name: N-(1,3-benzodioxol-5-yl)-2-[4-(2,4-dimethylphenyl)sulfonylpiperazino]acetamide Formula: C21H25N3O5S MolecularWeight: 431.5053

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)S(=O)(=O)N2CCN(CC2)CC(=O)NC3=CC4=C(C=C3)OCO4)C

Isomeric SMILES

CC1=CC(=C(C=C1)S(=O)(=O)N2CCN(CC2)CC(=O)NC3=CC4=C(C=C3)OCO4)C

InChI

InChI=1S/C21H25N3O5S/c1-15-3-6-20(16(2)11-15)30(26,27)24-9-7-23(8-10-24)13-21(25)22-17-4-5-18-19(12-17)29-14-28-18/h3-6,11-12H,7-10,13-14H2,1-2H3,(H,22,25)