2-(1,3-benzothiazol-2-ylamino)-4-methyl-N-[3-(trifluoromethyl)phenyl]pyrimidine-5-carboxamide

Systemtic Name: 2-(1,3-benzothiazol-2-ylamino)-4-methyl-N-[3-(trifluoromethyl)phenyl]pyrimidine-5-carboxamide Openeye Name: 2-(1,3-benzothiazol-2-ylamino)-4-methyl-N-[3-(trifluoromethyl)phenyl]pyrimidine-5-carboxamide CAS Name: 2-(1,3-benzothiazol-2-ylamino)-4-methyl-N-[3-(trifluoromethyl)phenyl]-5-pyrimidinecarboxamide IUPAC Name: 2-(1,3-benzothiazol-2-ylamino)-4-methyl-N-[3-(trifluoromethyl)phenyl]pyrimidine-5-carboxamide Traditional Name: 2-(1,3-benzothiazol-2-ylamino)-4-methyl-N-[3-(trifluoromethyl)phenyl]pyrimidine-5-carboxamide Formula: C20H14F3N5OS MolecularWeight: 429.41827

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC=C1C(=O)NC2=CC=CC(=C2)C(F)(F)F)NC3=NC4=CC=CC=C4S3

Isomeric SMILES

CC1=NC(=NC=C1C(=O)NC2=CC=CC(=C2)C(F)(F)F)NC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C20H14F3N5OS/c1-11-14(17(29)26-13-6-4-5-12(9-13)20(21,22)23)10-24-18(25-11)28-19-27-15-7-2-3-8-16(15)30-19/h2-10H,1H3,(H,26,29)(H,24,25,27,28)