6-bromanyl-2-chloranyl-N-(4-methylphenyl)sulfonyl-3-(pyridin-3-ylmethylamino)benzamide

Systemtic Name: 6-bromanyl-2-chloranyl-N-(4-methylphenyl)sulfonyl-3-(pyridin-3-ylmethylamino)benzamide Openeye Name: 6-bromo-2-chloro-N-(p-tolylsulfonyl)-3-(3-pyridylmethylamino)benzamide CAS Name: 6-bromo-2-chloro-N-(4-methylphenyl)sulfonyl-3-(3-pyridinylmethylamino)benzamide IUPAC Name: 6-bromo-2-chloro-N-(4-methylphenyl)sulfonyl-3-(pyridin-3-ylmethylamino)benzamide Traditional Name: 6-bromo-2-chloro-3-(3-pyridylmethylamino)-N-tosyl-benzamide Formula: C20H17BrClN3O3S MolecularWeight: 494.78928

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(=O)C2=C(C=CC(=C2Cl)NCC3=CN=CC=C3)Br

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC(=O)C2=C(C=CC(=C2Cl)NCC3=CN=CC=C3)Br

InChI

InChI=1S/C20H17BrClN3O3S/c1-13-4-6-15(7-5-13)29(27,28)25-20(26)18-16(21)8-9-17(19(18)22)24-12-14-3-2-10-23-11-14/h2-11,24H,12H2,1H3,(H,25,26)