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

Systemtic Name: 2-[(5-chloranyl-2-methyl-phenyl)-(phenylsulfonyl)amino]-N-(pyridin-4-ylmethyl)ethanamide Openeye Name: 2-[N-(benzenesulfonyl)-5-chloro-2-methyl-anilino]-N-(4-pyridylmethyl)acetamide CAS Name: 2-[N-(benzenesulfonyl)-5-chloro-2-methylanilino]-N-(pyridin-4-ylmethyl)acetamide IUPAC Name: 2-[N-(benzenesulfonyl)-5-chloro-2-methylanilino]-N-(pyridin-4-ylmethyl)acetamide Traditional Name: 2-(N-besyl-5-chloro-2-methyl-anilino)-N-(4-pyridylmethyl)acetamide Formula: C21H20ClN3O3S MolecularWeight: 429.9198

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H20ClN3O3S/c1-16-7-8-18(22)13-20(16)25(29(27,28)19-5-3-2-4-6-19)15-21(26)24-14-17-9-11-23-12-10-17/h2-13H,14-15H2,1H3,(H,24,26)