4-(1,3-benzothiazol-2-yl)-N-[2-morpholin-4-yl-5-(trifluoromethyl)phenyl]butanamide

Systemtic Name: 4-(1,3-benzothiazol-2-yl)-N-[2-morpholin-4-yl-5-(trifluoromethyl)phenyl]butanamide Openeye Name: 4-(1,3-benzothiazol-2-yl)-N-[2-morpholino-5-(trifluoromethyl)phenyl]butanamide CAS Name: 4-(1,3-benzothiazol-2-yl)-N-[2-(4-morpholinyl)-5-(trifluoromethyl)phenyl]butanamide IUPAC Name: 4-(1,3-benzothiazol-2-yl)-N-[2-morpholin-4-yl-5-(trifluoromethyl)phenyl]butanamide Traditional Name: 4-(1,3-benzothiazol-2-yl)-N-[2-morpholino-5-(trifluoromethyl)phenyl]butyramide Formula: C22H22F3N3O2S MolecularWeight: 449.48919

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=C(C=C(C=C2)C(F)(F)F)NC(=O)CCCC3=NC4=CC=CC=C4S3

Isomeric SMILES

C1COCCN1C2=C(C=C(C=C2)C(F)(F)F)NC(=O)CCCC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C22H22F3N3O2S/c23-22(24,25)15-8-9-18(28-10-12-30-13-11-28)17(14-15)26-20(29)6-3-7-21-27-16-4-1-2-5-19(16)31-21/h1-2,4-5,8-9,14H,3,6-7,10-13H2,(H,26,29)