2-[(6-ethylpyrimidin-4-yl)amino]-N-(2,4,6-trimethylphenyl)-1,3-benzothiazole-6-carboxamide

Systemtic Name: 2-[(6-ethylpyrimidin-4-yl)amino]-N-(2,4,6-trimethylphenyl)-1,3-benzothiazole-6-carboxamide Openeye Name: 2-[(6-ethylpyrimidin-4-yl)amino]-N-(2,4,6-trimethylphenyl)-1,3-benzothiazole-6-carboxamide CAS Name: 2-[(6-ethyl-4-pyrimidinyl)amino]-N-(2,4,6-trimethylphenyl)-1,3-benzothiazole-6-carboxamide IUPAC Name: 2-[(6-ethylpyrimidin-4-yl)amino]-N-(2,4,6-trimethylphenyl)-1,3-benzothiazole-6-carboxamide Traditional Name: 2-[(6-ethylpyrimidin-4-yl)amino]-N-mesityl-1,3-benzothiazole-6-carboxamide Formula: C23H23N5OS MolecularWeight: 417.52662

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=NC=N1)NC2=NC3=C(S2)C=C(C=C3)C(=O)NC4=C(C=C(C=C4C)C)C

Isomeric SMILES

CCC1=CC(=NC=N1)NC2=NC3=C(S2)C=C(C=C3)C(=O)NC4=C(C=C(C=C4C)C)C

InChI

InChI=1S/C23H23N5OS/c1-5-17-11-20(25-12-24-17)27-23-26-18-7-6-16(10-19(18)30-23)22(29)28-21-14(3)8-13(2)9-15(21)4/h6-12H,5H2,1-4H3,(H,28,29)(H,24,25,26,27)