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

Systemtic Name: 2-[(4-methylphenyl)sulfonyl-(phenylmethyl)amino]-N-(pyridin-4-ylmethyl)ethanamide Openeye Name: 2-[benzyl(p-tolylsulfonyl)amino]-N-(4-pyridylmethyl)acetamide CAS Name: 2-[(4-methylphenyl)sulfonyl-(phenylmethyl)amino]-N-(pyridin-4-ylmethyl)acetamide IUPAC Name: 2-[benzyl-(4-methylphenyl)sulfonylamino]-N-(pyridin-4-ylmethyl)acetamide Traditional Name: 2-[benzyl(tosyl)amino]-N-(4-pyridylmethyl)acetamide Formula: C22H23N3O3S MolecularWeight: 409.50132

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N(CC2=CC=CC=C2)CC(=O)NCC3=CC=NC=C3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(CC2=CC=CC=C2)CC(=O)NCC3=CC=NC=C3

InChI

InChI=1S/C22H23N3O3S/c1-18-7-9-21(10-8-18)29(27,28)25(16-20-5-3-2-4-6-20)17-22(26)24-15-19-11-13-23-14-12-19/h2-14H,15-17H2,1H3,(H,24,26)