2-[cyclohexyl-(4-methylphenyl)sulfonyl-amino]-N-(pyridin-2-ylmethyl)ethanamide

Systemtic Name: 2-[cyclohexyl-(4-methylphenyl)sulfonyl-amino]-N-(pyridin-2-ylmethyl)ethanamide Openeye Name: 2-[cyclohexyl(p-tolylsulfonyl)amino]-N-(2-pyridylmethyl)acetamide CAS Name: 2-[cyclohexyl-(4-methylphenyl)sulfonylamino]-N-(2-pyridinylmethyl)acetamide IUPAC Name: 2-[cyclohexyl-(4-methylphenyl)sulfonylamino]-N-(pyridin-2-ylmethyl)acetamide Traditional Name: 2-[cyclohexyl(tosyl)amino]-N-(2-pyridylmethyl)acetamide Formula: C21H27N3O3S MolecularWeight: 401.52238

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N(CC(=O)NCC2=CC=CC=N2)C3CCCCC3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(CC(=O)NCC2=CC=CC=N2)C3CCCCC3

InChI

InChI=1S/C21H27N3O3S/c1-17-10-12-20(13-11-17)28(26,27)24(19-8-3-2-4-9-19)16-21(25)23-15-18-7-5-6-14-22-18/h5-7,10-14,19H,2-4,8-9,15-16H2,1H3,(H,23,25)