N-(2,6-dimethylphenyl)-2-[4-(2-methylsulfonylpropanoyl)piperazin-1-yl]ethanamide

Systemtic Name: N-(2,6-dimethylphenyl)-2-[4-(2-methylsulfonylpropanoyl)piperazin-1-yl]ethanamide Openeye Name: N-(2,6-dimethylphenyl)-2-[4-(2-methylsulfonylpropanoyl)piperazin-1-yl]acetamide CAS Name: N-(2,6-dimethylphenyl)-2-[4-(2-methylsulfonyl-1-oxopropyl)-1-piperazinyl]acetamide IUPAC Name: N-(2,6-dimethylphenyl)-2-[4-(2-methylsulfonylpropanoyl)piperazin-1-yl]acetamide Traditional Name: N-(2,6-dimethylphenyl)-2-[4-(2-mesylpropanoyl)piperazino]acetamide Formula: C18H27N3O4S MolecularWeight: 381.48968

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)NC(=O)CN2CCN(CC2)C(=O)C(C)S(=O)(=O)C

Isomeric SMILES

CC1=C(C(=CC=C1)C)NC(=O)CN2CCN(CC2)C(=O)C(C)S(=O)(=O)C

InChI

InChI=1S/C18H27N3O4S/c1-13-6-5-7-14(2)17(13)19-16(22)12-20-8-10-21(11-9-20)18(23)15(3)26(4,24)25/h5-7,15H,8-12H2,1-4H3,(H,19,22)