N-(2-morpholin-4-yl-1,3-benzothiazol-6-yl)-3-(pyrimidin-2-ylamino)benzamide

Systemtic Name: N-(2-morpholin-4-yl-1,3-benzothiazol-6-yl)-3-(pyrimidin-2-ylamino)benzamide Openeye Name: N-(2-morpholino-1,3-benzothiazol-6-yl)-3-(pyrimidin-2-ylamino)benzamide CAS Name: N-[2-(4-morpholinyl)-1,3-benzothiazol-6-yl]-3-(2-pyrimidinylamino)benzamide IUPAC Name: N-(2-morpholin-4-yl-1,3-benzothiazol-6-yl)-3-(pyrimidin-2-ylamino)benzamide Traditional Name: N-(2-morpholino-1,3-benzothiazol-6-yl)-3-(2-pyrimidylamino)benzamide Formula: C22H20N6O2S MolecularWeight: 432.4982

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=NC3=C(S2)C=C(C=C3)NC(=O)C4=CC(=CC=C4)NC5=NC=CC=N5

Isomeric SMILES

C1COCCN1C2=NC3=C(S2)C=C(C=C3)NC(=O)C4=CC(=CC=C4)NC5=NC=CC=N5

InChI

InChI=1S/C22H20N6O2S/c29-20(15-3-1-4-16(13-15)26-21-23-7-2-8-24-21)25-17-5-6-18-19(14-17)31-22(27-18)28-9-11-30-12-10-28/h1-8,13-14H,9-12H2,(H,25,29)(H,23,24,26)