2,8-dimethyl-N-(3-methylphenyl)-4-oxidanylidene-pyrimido[2,1-b][1,3]benzothiazole-3-sulfonamide

Systemtic Name: 2,8-dimethyl-N-(3-methylphenyl)-4-oxidanylidene-pyrimido[2,1-b][1,3]benzothiazole-3-sulfonamide Openeye Name: 2,8-dimethyl-N-(m-tolyl)-4-oxo-pyrimido[2,1-b][1,3]benzothiazole-3-sulfonamide CAS Name: 2,8-dimethyl-N-(3-methylphenyl)-4-oxo-3-pyrimido[2,1-b][1,3]benzothiazolesulfonamide IUPAC Name: 2,8-dimethyl-N-(3-methylphenyl)-4-oxopyrimido[2,1-b][1,3]benzothiazole-3-sulfonamide Traditional Name: 4-keto-2,8-dimethyl-N-(m-tolyl)pyrimido[2,1-b][1,3]benzothiazole-3-sulfonamide Formula: C19H17N3O3S2 MolecularWeight: 399.48658

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NS(=O)(=O)C2=C(N=C3N(C2=O)C4=C(S3)C=C(C=C4)C)C

Isomeric SMILES

CC1=CC(=CC=C1)NS(=O)(=O)C2=C(N=C3N(C2=O)C4=C(S3)C=C(C=C4)C)C

InChI

InChI=1S/C19H17N3O3S2/c1-11-5-4-6-14(9-11)21-27(24,25)17-13(3)20-19-22(18(17)23)15-8-7-12(2)10-16(15)26-19/h4-10,21H,1-3H3