4-(4-chloranyl-2-methyl-phenoxy)-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)butanamide

Systemtic Name: 4-(4-chloranyl-2-methyl-phenoxy)-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)butanamide Openeye Name: 4-(4-chloro-2-methyl-phenoxy)-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)butanamide CAS Name: 4-(4-chloro-2-methylphenoxy)-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)butanamide IUPAC Name: 4-(4-chloro-2-methylphenoxy)-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)butanamide Traditional Name: 4-(4-chloro-2-methyl-phenoxy)-N-(6-mesyl-1,3-benzothiazol-2-yl)butyramide Formula: C19H19ClN2O4S2 MolecularWeight: 438.94816

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Cl)OCCCC(=O)NC2=NC3=C(S2)C=C(C=C3)S(=O)(=O)C

Isomeric SMILES

CC1=C(C=CC(=C1)Cl)OCCCC(=O)NC2=NC3=C(S2)C=C(C=C3)S(=O)(=O)C

InChI

InChI=1S/C19H19ClN2O4S2/c1-12-10-13(20)5-8-16(12)26-9-3-4-18(23)22-19-21-15-7-6-14(28(2,24)25)11-17(15)27-19/h5-8,10-11H,3-4,9H2,1-2H3,(H,21,22,23)