2-[(2,5-dimethylphenyl)-methylsulfonyl-amino]-N-[3-(4-methylpiperidin-1-yl)propyl]propanamide

Systemtic Name: 2-[(2,5-dimethylphenyl)-methylsulfonyl-amino]-N-[3-(4-methylpiperidin-1-yl)propyl]propanamide Openeye Name: 2-(2,5-dimethyl-N-methylsulfonyl-anilino)-N-[3-(4-methyl-1-piperidyl)propyl]propanamide CAS Name: 2-(2,5-dimethyl-N-methylsulfonylanilino)-N-[3-(4-methyl-1-piperidinyl)propyl]propanamide IUPAC Name: 2-(2,5-dimethyl-N-methylsulfonylanilino)-N-[3-(4-methylpiperidin-1-yl)propyl]propanamide Traditional Name: 2-(N-mesyl-2,5-dimethyl-anilino)-N-[3-(4-methylpiperidino)propyl]propionamide Formula: C21H35N3O3S MolecularWeight: 409.5859

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)CCCNC(=O)C(C)N(C2=C(C=CC(=C2)C)C)S(=O)(=O)C

Isomeric SMILES

CC1CCN(CC1)CCCNC(=O)C(C)N(C2=C(C=CC(=C2)C)C)S(=O)(=O)C

InChI

InChI=1S/C21H35N3O3S/c1-16-9-13-23(14-10-16)12-6-11-22-21(25)19(4)24(28(5,26)27)20-15-17(2)7-8-18(20)3/h7-8,15-16,19H,6,9-14H2,1-5H3,(H,22,25)