N-(4-fluorophenyl)-4-methyl-2-[(4-phenyl-1,3-thiazol-2-yl)amino]pyrimidine-5-carboxamide

Systemtic Name: N-(4-fluorophenyl)-4-methyl-2-[(4-phenyl-1,3-thiazol-2-yl)amino]pyrimidine-5-carboxamide Openeye Name: N-(4-fluorophenyl)-4-methyl-2-[(4-phenylthiazol-2-yl)amino]pyrimidine-5-carboxamide CAS Name: N-(4-fluorophenyl)-4-methyl-2-[(4-phenyl-2-thiazolyl)amino]-5-pyrimidinecarboxamide IUPAC Name: N-(4-fluorophenyl)-4-methyl-2-[(4-phenyl-1,3-thiazol-2-yl)amino]pyrimidine-5-carboxamide Traditional Name: N-(4-fluorophenyl)-4-methyl-2-[(4-phenylthiazol-2-yl)amino]pyrimidine-5-carboxamide Formula: C21H16FN5OS MolecularWeight: 405.448043

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC=C1C(=O)NC2=CC=C(C=C2)F)NC3=NC(=CS3)C4=CC=CC=C4

Isomeric SMILES

CC1=NC(=NC=C1C(=O)NC2=CC=C(C=C2)F)NC3=NC(=CS3)C4=CC=CC=C4

InChI

InChI=1S/C21H16FN5OS/c1-13-17(19(28)25-16-9-7-15(22)8-10-16)11-23-20(24-13)27-21-26-18(12-29-21)14-5-3-2-4-6-14/h2-12H,1H3,(H,25,28)(H,23,24,26,27)