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

Systemtic Name: N-(4-bromophenyl)-2-methyl-4-oxidanylidene-pyrimido[2,1-b][1,3]benzothiazole-3-sulfonamide Openeye Name: N-(4-bromophenyl)-2-methyl-4-oxo-pyrimido[2,1-b][1,3]benzothiazole-3-sulfonamide CAS Name: N-(4-bromophenyl)-2-methyl-4-oxo-3-pyrimido[2,1-b][1,3]benzothiazolesulfonamide IUPAC Name: N-(4-bromophenyl)-2-methyl-4-oxopyrimido[2,1-b][1,3]benzothiazole-3-sulfonamide Traditional Name: N-(4-bromophenyl)-4-keto-2-methyl-pyrimido[2,1-b][1,3]benzothiazole-3-sulfonamide Formula: C17H12BrN3O3S2 MolecularWeight: 450.32948

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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)Br

Isomeric SMILES

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

InChI

InChI=1S/C17H12BrN3O3S2/c1-10-15(26(23,24)20-12-8-6-11(18)7-9-12)16(22)21-13-4-2-3-5-14(13)25-17(21)19-10/h2-9,20H,1H3