2-methyl-N-[4-(2-methyl-4-oxidanylidene-quinazolin-3-yl)phenyl]-1,3-benzothiazole-6-sulfonamide

Systemtic Name: 2-methyl-N-[4-(2-methyl-4-oxidanylidene-quinazolin-3-yl)phenyl]-1,3-benzothiazole-6-sulfonamide Openeye Name: 2-methyl-N-[4-(2-methyl-4-oxo-quinazolin-3-yl)phenyl]-1,3-benzothiazole-6-sulfonamide CAS Name: 2-methyl-N-[4-(2-methyl-4-oxo-3-quinazolinyl)phenyl]-1,3-benzothiazole-6-sulfonamide IUPAC Name: 2-methyl-N-[4-(2-methyl-4-oxoquinazolin-3-yl)phenyl]-1,3-benzothiazole-6-sulfonamide Traditional Name: N-[4-(4-keto-2-methyl-quinazolin-3-yl)phenyl]-2-methyl-1,3-benzothiazole-6-sulfonamide Formula: C23H18N4O3S2 MolecularWeight: 462.54402

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2C(=O)N1C3=CC=C(C=C3)NS(=O)(=O)C4=CC5=C(C=C4)N=C(S5)C

Isomeric SMILES

CC1=NC2=CC=CC=C2C(=O)N1C3=CC=C(C=C3)NS(=O)(=O)C4=CC5=C(C=C4)N=C(S5)C

InChI

InChI=1S/C23H18N4O3S2/c1-14-24-20-6-4-3-5-19(20)23(28)27(14)17-9-7-16(8-10-17)26-32(29,30)18-11-12-21-22(13-18)31-15(2)25-21/h3-13,26H,1-2H3