N-(2-methylsulfanyl-1,3-benzothiazol-6-yl)-3-(pyrimidin-2-ylamino)benzamide

Systemtic Name: N-(2-methylsulfanyl-1,3-benzothiazol-6-yl)-3-(pyrimidin-2-ylamino)benzamide Openeye Name: N-(2-methylsulfanyl-1,3-benzothiazol-6-yl)-3-(pyrimidin-2-ylamino)benzamide CAS Name: N-[2-(methylthio)-1,3-benzothiazol-6-yl]-3-(2-pyrimidinylamino)benzamide IUPAC Name: N-(2-methylsulfanyl-1,3-benzothiazol-6-yl)-3-(pyrimidin-2-ylamino)benzamide Traditional Name: N-[2-(methylthio)-1,3-benzothiazol-6-yl]-3-(2-pyrimidylamino)benzamide Formula: C19H15N5OS2 MolecularWeight: 393.4853

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC2=C(S1)C=C(C=C2)NC(=O)C3=CC(=CC=C3)NC4=NC=CC=N4

Isomeric SMILES

CSC1=NC2=C(S1)C=C(C=C2)NC(=O)C3=CC(=CC=C3)NC4=NC=CC=N4

InChI

InChI=1S/C19H15N5OS2/c1-26-19-24-15-7-6-14(11-16(15)27-19)22-17(25)12-4-2-5-13(10-12)23-18-20-8-3-9-21-18/h2-11H,1H3,(H,22,25)(H,20,21,23)