N-[[4-(2-methyl-1,3-thiazol-4-yl)phenyl]methyl]-3-(pyrimidin-2-ylamino)benzamide

Systemtic Name: N-[[4-(2-methyl-1,3-thiazol-4-yl)phenyl]methyl]-3-(pyrimidin-2-ylamino)benzamide Openeye Name: N-[[4-(2-methylthiazol-4-yl)phenyl]methyl]-3-(pyrimidin-2-ylamino)benzamide CAS Name: N-[[4-(2-methyl-4-thiazolyl)phenyl]methyl]-3-(2-pyrimidinylamino)benzamide IUPAC Name: N-[[4-(2-methyl-1,3-thiazol-4-yl)phenyl]methyl]-3-(pyrimidin-2-ylamino)benzamide Traditional Name: N-[4-(2-methylthiazol-4-yl)benzyl]-3-(2-pyrimidylamino)benzamide Formula: C22H19N5OS MolecularWeight: 401.48416

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CS1)C2=CC=C(C=C2)CNC(=O)C3=CC(=CC=C3)NC4=NC=CC=N4

Isomeric SMILES

CC1=NC(=CS1)C2=CC=C(C=C2)CNC(=O)C3=CC(=CC=C3)NC4=NC=CC=N4

InChI

InChI=1S/C22H19N5OS/c1-15-26-20(14-29-15)17-8-6-16(7-9-17)13-25-21(28)18-4-2-5-19(12-18)27-22-23-10-3-11-24-22/h2-12,14H,13H2,1H3,(H,25,28)(H,23,24,27)