2-[(5-chloranyl-2-methyl-phenyl)-(4-methylphenyl)sulfonyl-amino]-N-(pyridin-3-ylmethyl)ethanamide

Systemtic Name: 2-[(5-chloranyl-2-methyl-phenyl)-(4-methylphenyl)sulfonyl-amino]-N-(pyridin-3-ylmethyl)ethanamide Openeye Name: 2-[5-chloro-2-methyl-N-(p-tolylsulfonyl)anilino]-N-(3-pyridylmethyl)acetamide CAS Name: 2-(5-chloro-2-methyl-N-(4-methylphenyl)sulfonylanilino)-N-(3-pyridinylmethyl)acetamide IUPAC Name: 2-(5-chloro-2-methyl-N-(4-methylphenyl)sulfonylanilino)-N-(pyridin-3-ylmethyl)acetamide Traditional Name: 2-(5-chloro-2-methyl-N-tosyl-anilino)-N-(3-pyridylmethyl)acetamide Formula: C22H22ClN3O3S MolecularWeight: 443.94638

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N(CC(=O)NCC2=CN=CC=C2)C3=C(C=CC(=C3)Cl)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(CC(=O)NCC2=CN=CC=C2)C3=C(C=CC(=C3)Cl)C

InChI

InChI=1S/C22H22ClN3O3S/c1-16-5-9-20(10-6-16)30(28,29)26(21-12-19(23)8-7-17(21)2)15-22(27)25-14-18-4-3-11-24-13-18/h3-13H,14-15H2,1-2H3,(H,25,27)