2-[(3,5-dimethylphenyl)-methylsulfonyl-amino]-N-(3-phenylpropyl)propanamide

Systemtic Name: 2-[(3,5-dimethylphenyl)-methylsulfonyl-amino]-N-(3-phenylpropyl)propanamide Openeye Name: 2-(3,5-dimethyl-N-methylsulfonyl-anilino)-N-(3-phenylpropyl)propanamide CAS Name: 2-(3,5-dimethyl-N-methylsulfonylanilino)-N-(3-phenylpropyl)propanamide IUPAC Name: 2-(3,5-dimethyl-N-methylsulfonylanilino)-N-(3-phenylpropyl)propanamide Traditional Name: 2-(N-mesyl-3,5-dimethyl-anilino)-N-(3-phenylpropyl)propionamide Formula: C21H28N2O3S MolecularWeight: 388.52362

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)N(C(C)C(=O)NCCCC2=CC=CC=C2)S(=O)(=O)C)C

Isomeric SMILES

CC1=CC(=CC(=C1)N(C(C)C(=O)NCCCC2=CC=CC=C2)S(=O)(=O)C)C

InChI

InChI=1S/C21H28N2O3S/c1-16-13-17(2)15-20(14-16)23(27(4,25)26)18(3)21(24)22-12-8-11-19-9-6-5-7-10-19/h5-7,9-10,13-15,18H,8,11-12H2,1-4H3,(H,22,24)