N-[4-(cyclohexylmethylamino)-2-oxidanylidene-chromen-3-yl]-2,1,3-benzothiadiazole-4-sulfonamide

Systemtic Name: N-[4-(cyclohexylmethylamino)-2-oxidanylidene-chromen-3-yl]-2,1,3-benzothiadiazole-4-sulfonamide Openeye Name: N-[4-(cyclohexylmethylamino)-2-oxo-chromen-3-yl]-2,1,3-benzothiadiazole-4-sulfonamide CAS Name: N-[4-(cyclohexylmethylamino)-2-oxo-1-benzopyran-3-yl]-2,1,3-benzothiadiazole-4-sulfonamide IUPAC Name: N-[4-(cyclohexylmethylamino)-2-oxochromen-3-yl]-2,1,3-benzothiadiazole-4-sulfonamide Traditional Name: N-[4-(cyclohexylmethylamino)-2-keto-chromen-3-yl]piazthiole-4-sulfonamide Formula: C22H22N4O4S2 MolecularWeight: 470.56448

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CNC2=C(C(=O)OC3=CC=CC=C32)NS(=O)(=O)C4=CC=CC5=NSN=C54

Isomeric SMILES

C1CCC(CC1)CNC2=C(C(=O)OC3=CC=CC=C32)NS(=O)(=O)C4=CC=CC5=NSN=C54

InChI

InChI=1S/C22H22N4O4S2/c27-22-21(26-32(28,29)18-12-6-10-16-20(18)25-31-24-16)19(15-9-4-5-11-17(15)30-22)23-13-14-7-2-1-3-8-14/h4-6,9-12,14,23,26H,1-3,7-8,13H2