4-(4-cyano-2-methoxy-phenoxy)-N-(4,6-dimethyl-1,3-benzothiazol-2-yl)butanamide

Systemtic Name: 4-(4-cyano-2-methoxy-phenoxy)-N-(4,6-dimethyl-1,3-benzothiazol-2-yl)butanamide Openeye Name: 4-(4-cyano-2-methoxy-phenoxy)-N-(4,6-dimethyl-1,3-benzothiazol-2-yl)butanamide CAS Name: 4-(4-cyano-2-methoxyphenoxy)-N-(4,6-dimethyl-1,3-benzothiazol-2-yl)butanamide IUPAC Name: 4-(4-cyano-2-methoxyphenoxy)-N-(4,6-dimethyl-1,3-benzothiazol-2-yl)butanamide Traditional Name: 4-(4-cyano-2-methoxy-phenoxy)-N-(4,6-dimethyl-1,3-benzothiazol-2-yl)butyramide Formula: C21H21N3O3S MolecularWeight: 395.47474

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)SC(=N2)NC(=O)CCCOC3=C(C=C(C=C3)C#N)OC)C

Isomeric SMILES

CC1=CC(=C2C(=C1)SC(=N2)NC(=O)CCCOC3=C(C=C(C=C3)C#N)OC)C

InChI

InChI=1S/C21H21N3O3S/c1-13-9-14(2)20-18(10-13)28-21(24-20)23-19(25)5-4-8-27-16-7-6-15(12-22)11-17(16)26-3/h6-7,9-11H,4-5,8H2,1-3H3,(H,23,24,25)