N-(2-phenylazanyl-1,3-benzothiazol-4-yl)-3,5-bis(trifluoromethyl)benzamide

Systemtic Name: N-(2-phenylazanyl-1,3-benzothiazol-4-yl)-3,5-bis(trifluoromethyl)benzamide Openeye Name: N-(2-anilino-1,3-benzothiazol-4-yl)-3,5-bis(trifluoromethyl)benzamide CAS Name: N-(2-anilino-1,3-benzothiazol-4-yl)-3,5-bis(trifluoromethyl)benzamide IUPAC Name: N-(2-anilino-1,3-benzothiazol-4-yl)-3,5-bis(trifluoromethyl)benzamide Traditional Name: N-(2-anilino-1,3-benzothiazol-4-yl)-3,5-bis(trifluoromethyl)benzamide Formula: C22H13F6N3OS MolecularWeight: 481.413539

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC2=NC3=C(C=CC=C3S2)NC(=O)C4=CC(=CC(=C4)C(F)(F)F)C(F)(F)F

Isomeric SMILES

C1=CC=C(C=C1)NC2=NC3=C(C=CC=C3S2)NC(=O)C4=CC(=CC(=C4)C(F)(F)F)C(F)(F)F

InChI

InChI=1S/C22H13F6N3OS/c23-21(24,25)13-9-12(10-14(11-13)22(26,27)28)19(32)30-16-7-4-8-17-18(16)31-20(33-17)29-15-5-2-1-3-6-15/h1-11H,(H,29,31)(H,30,32)