N-[3-[cyclopropyl-(2-oxidanyl-4-oxidanylidene-chromen-3-yl)methyl]phenyl]quinazoline-2-sulfonamide

Systemtic Name: N-[3-[cyclopropyl-(2-oxidanyl-4-oxidanylidene-chromen-3-yl)methyl]phenyl]quinazoline-2-sulfonamide Openeye Name: N-[3-[cyclopropyl-(2-hydroxy-4-oxo-chromen-3-yl)methyl]phenyl]quinazoline-2-sulfonamide CAS Name: N-[3-[cyclopropyl-(2-hydroxy-4-oxo-1-benzopyran-3-yl)methyl]phenyl]-2-quinazolinesulfonamide IUPAC Name: N-[3-[cyclopropyl-(2-hydroxy-4-oxochromen-3-yl)methyl]phenyl]quinazoline-2-sulfonamide Traditional Name: N-[3-[cyclopropyl-(2-hydroxy-4-keto-chromen-3-yl)methyl]phenyl]quinazoline-2-sulfonamide Formula: C27H21N3O5S MolecularWeight: 499.53774

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C(C2=CC(=CC=C2)NS(=O)(=O)C3=NC4=CC=CC=C4C=N3)C5=C(OC6=CC=CC=C6C5=O)O

Isomeric SMILES

C1CC1C(C2=CC(=CC=C2)NS(=O)(=O)C3=NC4=CC=CC=C4C=N3)C5=C(OC6=CC=CC=C6C5=O)O

InChI

InChI=1S/C27H21N3O5S/c31-25-20-9-2-4-11-22(20)35-26(32)24(25)23(16-12-13-16)17-7-5-8-19(14-17)30-36(33,34)27-28-15-18-6-1-3-10-21(18)29-27/h1-11,14-16,23,30,32H,12-13H2