N-[4-methyl-3-[(4-pyridin-3-ylpyrimidin-2-yl)amino]phenyl]-1,3-benzothiazole-6-carboxamide

Systemtic Name: N-[4-methyl-3-[(4-pyridin-3-ylpyrimidin-2-yl)amino]phenyl]-1,3-benzothiazole-6-carboxamide Openeye Name: N-[4-methyl-3-[[4-(3-pyridyl)pyrimidin-2-yl]amino]phenyl]-1,3-benzothiazole-6-carboxamide CAS Name: N-[4-methyl-3-[[4-(3-pyridinyl)-2-pyrimidinyl]amino]phenyl]-1,3-benzothiazole-6-carboxamide IUPAC Name: N-[4-methyl-3-[(4-pyridin-3-ylpyrimidin-2-yl)amino]phenyl]-1,3-benzothiazole-6-carboxamide Traditional Name: N-[4-methyl-3-[[4-(3-pyridyl)pyrimidin-2-yl]amino]phenyl]-1,3-benzothiazole-6-carboxamide Formula: C24H18N6OS MolecularWeight: 438.50432

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C2=CC3=C(C=C2)N=CS3)NC4=NC=CC(=N4)C5=CN=CC=C5

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C2=CC3=C(C=C2)N=CS3)NC4=NC=CC(=N4)C5=CN=CC=C5

InChI

InChI=1S/C24H18N6OS/c1-15-4-6-18(28-23(31)16-5-7-20-22(11-16)32-14-27-20)12-21(15)30-24-26-10-8-19(29-24)17-3-2-9-25-13-17/h2-14H,1H3,(H,28,31)(H,26,29,30)