2-methyl-N-(4-morpholin-4-ylphenyl)-4-oxidanylidene-pyrimido[2,1-b][1,3]benzothiazole-3-sulfonamide

Systemtic Name: 2-methyl-N-(4-morpholin-4-ylphenyl)-4-oxidanylidene-pyrimido[2,1-b][1,3]benzothiazole-3-sulfonamide Openeye Name: 2-methyl-N-(4-morpholinophenyl)-4-oxo-pyrimido[2,1-b][1,3]benzothiazole-3-sulfonamide CAS Name: 2-methyl-N-[4-(4-morpholinyl)phenyl]-4-oxo-3-pyrimido[2,1-b][1,3]benzothiazolesulfonamide IUPAC Name: 2-methyl-N-(4-morpholin-4-ylphenyl)-4-oxopyrimido[2,1-b][1,3]benzothiazole-3-sulfonamide Traditional Name: 4-keto-2-methyl-N-(4-morpholinophenyl)pyrimido[2,1-b][1,3]benzothiazole-3-sulfonamide Formula: C21H20N4O4S2 MolecularWeight: 456.5379

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N2C3=CC=CC=C3SC2=N1)S(=O)(=O)NC4=CC=C(C=C4)N5CCOCC5

Isomeric SMILES

CC1=C(C(=O)N2C3=CC=CC=C3SC2=N1)S(=O)(=O)NC4=CC=C(C=C4)N5CCOCC5

InChI

InChI=1S/C21H20N4O4S2/c1-14-19(20(26)25-17-4-2-3-5-18(17)30-21(25)22-14)31(27,28)23-15-6-8-16(9-7-15)24-10-12-29-13-11-24/h2-9,23H,10-13H2,1H3