2-[(3,4-dimethylphenyl)-methylsulfonyl-amino]-N-(3-piperidin-1-ylpropyl)propanamide

Systemtic Name: 2-[(3,4-dimethylphenyl)-methylsulfonyl-amino]-N-(3-piperidin-1-ylpropyl)propanamide Openeye Name: 2-(3,4-dimethyl-N-methylsulfonyl-anilino)-N-[3-(1-piperidyl)propyl]propanamide CAS Name: 2-(3,4-dimethyl-N-methylsulfonylanilino)-N-[3-(1-piperidinyl)propyl]propanamide IUPAC Name: 2-(3,4-dimethyl-N-methylsulfonylanilino)-N-(3-piperidin-1-ylpropyl)propanamide Traditional Name: 2-(N-mesyl-3,4-dimethyl-anilino)-N-(3-piperidinopropyl)propionamide Formula: C20H33N3O3S MolecularWeight: 395.55932

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N(C(C)C(=O)NCCCN2CCCCC2)S(=O)(=O)C)C

Isomeric SMILES

CC1=C(C=C(C=C1)N(C(C)C(=O)NCCCN2CCCCC2)S(=O)(=O)C)C

InChI

InChI=1S/C20H33N3O3S/c1-16-9-10-19(15-17(16)2)23(27(4,25)26)18(3)20(24)21-11-8-14-22-12-6-5-7-13-22/h9-10,15,18H,5-8,11-14H2,1-4H3,(H,21,24)