N-(1,3-benzothiazol-2-yl)-2,5-dimethyl-1-[2-(trifluoromethyl)phenyl]pyrrole-3-carboxamide

Systemtic Name: N-(1,3-benzothiazol-2-yl)-2,5-dimethyl-1-[2-(trifluoromethyl)phenyl]pyrrole-3-carboxamide Openeye Name: N-(1,3-benzothiazol-2-yl)-2,5-dimethyl-1-[2-(trifluoromethyl)phenyl]pyrrole-3-carboxamide CAS Name: N-(1,3-benzothiazol-2-yl)-2,5-dimethyl-1-[2-(trifluoromethyl)phenyl]-3-pyrrolecarboxamide IUPAC Name: N-(1,3-benzothiazol-2-yl)-2,5-dimethyl-1-[2-(trifluoromethyl)phenyl]pyrrole-3-carboxamide Traditional Name: N-(1,3-benzothiazol-2-yl)-2,5-dimethyl-1-[2-(trifluoromethyl)phenyl]pyrrole-3-carboxamide Formula: C21H16F3N3OS MolecularWeight: 415.43145

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=CC=CC=C2C(F)(F)F)C)C(=O)NC3=NC4=CC=CC=C4S3

Isomeric SMILES

CC1=CC(=C(N1C2=CC=CC=C2C(F)(F)F)C)C(=O)NC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C21H16F3N3OS/c1-12-11-14(19(28)26-20-25-16-8-4-6-10-18(16)29-20)13(2)27(12)17-9-5-3-7-15(17)21(22,23)24/h3-11H,1-2H3,(H,25,26,28)