2-(1H-benzimidazol-2-ylamino)-N-(4-methoxyphenyl)-4-oxidanylidene-1H-quinazoline-6-sulfonamide

Systemtic Name: 2-(1H-benzimidazol-2-ylamino)-N-(4-methoxyphenyl)-4-oxidanylidene-1H-quinazoline-6-sulfonamide Openeye Name: 2-(1H-benzimidazol-2-ylamino)-N-(4-methoxyphenyl)-4-oxo-1H-quinazoline-6-sulfonamide CAS Name: 2-(1H-benzimidazol-2-ylamino)-N-(4-methoxyphenyl)-4-oxo-1H-quinazoline-6-sulfonamide IUPAC Name: 2-(1H-benzimidazol-2-ylamino)-N-(4-methoxyphenyl)-4-oxo-1H-quinazoline-6-sulfonamide Traditional Name: 2-(1H-benzimidazol-2-ylamino)-4-keto-N-(4-methoxyphenyl)-1H-quinazoline-6-sulfonamide Formula: C22H18N6O4S MolecularWeight: 462.48112

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NS(=O)(=O)C2=CC3=C(C=C2)NC(=NC3=O)NC4=NC5=CC=CC=C5N4

Isomeric SMILES

COC1=CC=C(C=C1)NS(=O)(=O)C2=CC3=C(C=C2)NC(=NC3=O)NC4=NC5=CC=CC=C5N4

InChI

InChI=1S/C22H18N6O4S/c1-32-14-8-6-13(7-9-14)28-33(30,31)15-10-11-17-16(12-15)20(29)26-22(23-17)27-21-24-18-4-2-3-5-19(18)25-21/h2-12,28H,1H3,(H3,23,24,25,26,27,29)