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

Systemtic Name: N-(3-chloranyl-4-methyl-phenyl)-2-methyl-4-oxidanylidene-pyrimido[2,1-b][1,3]benzothiazole-3-sulfonamide Openeye Name: N-(3-chloro-4-methyl-phenyl)-2-methyl-4-oxo-pyrimido[2,1-b][1,3]benzothiazole-3-sulfonamide CAS Name: N-(3-chloro-4-methylphenyl)-2-methyl-4-oxo-3-pyrimido[2,1-b][1,3]benzothiazolesulfonamide IUPAC Name: N-(3-chloro-4-methylphenyl)-2-methyl-4-oxopyrimido[2,1-b][1,3]benzothiazole-3-sulfonamide Traditional Name: N-(3-chloro-4-methyl-phenyl)-4-keto-2-methyl-pyrimido[2,1-b][1,3]benzothiazole-3-sulfonamide Formula: C18H14ClN3O3S2 MolecularWeight: 419.90506

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NS(=O)(=O)C2=C(N=C3N(C2=O)C4=CC=CC=C4S3)C)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)NS(=O)(=O)C2=C(N=C3N(C2=O)C4=CC=CC=C4S3)C)Cl

InChI

InChI=1S/C18H14ClN3O3S2/c1-10-7-8-12(9-13(10)19)21-27(24,25)16-11(2)20-18-22(17(16)23)14-5-3-4-6-15(14)26-18/h3-9,21H,1-2H3