N-(4-chloranyl-1,3-benzothiazol-2-yl)-2-(4-methylphenyl)sulfonyl-N-(pyridin-2-ylmethyl)ethanamide

Systemtic Name: N-(4-chloranyl-1,3-benzothiazol-2-yl)-2-(4-methylphenyl)sulfonyl-N-(pyridin-2-ylmethyl)ethanamide Openeye Name: N-(4-chloro-1,3-benzothiazol-2-yl)-2-(p-tolylsulfonyl)-N-(2-pyridylmethyl)acetamide CAS Name: N-(4-chloro-1,3-benzothiazol-2-yl)-2-(4-methylphenyl)sulfonyl-N-(2-pyridinylmethyl)acetamide IUPAC Name: N-(4-chloro-1,3-benzothiazol-2-yl)-2-(4-methylphenyl)sulfonyl-N-(pyridin-2-ylmethyl)acetamide Traditional Name: N-(4-chloro-1,3-benzothiazol-2-yl)-N-(2-pyridylmethyl)-2-tosyl-acetamide Formula: C22H18ClN3O3S2 MolecularWeight: 471.97962

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)CC(=O)N(CC2=CC=CC=N2)C3=NC4=C(S3)C=CC=C4Cl

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)CC(=O)N(CC2=CC=CC=N2)C3=NC4=C(S3)C=CC=C4Cl

InChI

InChI=1S/C22H18ClN3O3S2/c1-15-8-10-17(11-9-15)31(28,29)14-20(27)26(13-16-5-2-3-12-24-16)22-25-21-18(23)6-4-7-19(21)30-22/h2-12H,13-14H2,1H3