2,6-dimethoxy-N-(4-methylsulfonyl-1,3-benzothiazol-2-yl)-N-(2-morpholin-4-ylethyl)pyrimidine-4-carboxamide

Systemtic Name: 2,6-dimethoxy-N-(4-methylsulfonyl-1,3-benzothiazol-2-yl)-N-(2-morpholin-4-ylethyl)pyrimidine-4-carboxamide Openeye Name: 2,6-dimethoxy-N-(4-methylsulfonyl-1,3-benzothiazol-2-yl)-N-(2-morpholinoethyl)pyrimidine-4-carboxamide CAS Name: 2,6-dimethoxy-N-(4-methylsulfonyl-1,3-benzothiazol-2-yl)-N-[2-(4-morpholinyl)ethyl]-4-pyrimidinecarboxamide IUPAC Name: 2,6-dimethoxy-N-(4-methylsulfonyl-1,3-benzothiazol-2-yl)-N-(2-morpholin-4-ylethyl)pyrimidine-4-carboxamide Traditional Name: N-(4-mesyl-1,3-benzothiazol-2-yl)-2,6-dimethoxy-N-(2-morpholinoethyl)pyrimidine-4-carboxamide Formula: C21H25N5O6S2 MolecularWeight: 507.5831

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Descriptors Computed from Structure

Canonical SMILES:

COC1=NC(=NC(=C1)C(=O)N(CCN2CCOCC2)C3=NC4=C(S3)C=CC=C4S(=O)(=O)C)OC

Isomeric SMILES

COC1=NC(=NC(=C1)C(=O)N(CCN2CCOCC2)C3=NC4=C(S3)C=CC=C4S(=O)(=O)C)OC

InChI

InChI=1S/C21H25N5O6S2/c1-30-17-13-14(22-20(23-17)31-2)19(27)26(8-7-25-9-11-32-12-10-25)21-24-18-15(33-21)5-4-6-16(18)34(3,28)29/h4-6,13H,7-12H2,1-3H3