N-[4-(diethylamino)-2-methyl-phenyl]-4H-chromeno[3,4-d][1,2]oxazole-8-sulfonamide

Systemtic Name: N-[4-(diethylamino)-2-methyl-phenyl]-4H-chromeno[3,4-d][1,2]oxazole-8-sulfonamide Openeye Name: N-[4-(diethylamino)-2-methyl-phenyl]-4H-chromeno[3,4-d]isoxazole-8-sulfonamide CAS Name: N-[4-(diethylamino)-2-methylphenyl]-4H-[1]benzopyrano[3,4-d]isoxazole-8-sulfonamide IUPAC Name: N-[4-(diethylamino)-2-methylphenyl]-4H-chromeno[3,4-d][1,2]oxazole-8-sulfonamide Traditional Name: N-[4-(diethylamino)-2-methyl-phenyl]-4H-chromen[3,4-d]isoxazole-8-sulfonamide Formula: C21H23N3O4S MolecularWeight: 413.49002

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=CC(=C(C=C1)NS(=O)(=O)C2=CC3=C(C=C2)OCC4=C3ON=C4)C

Isomeric SMILES

CCN(CC)C1=CC(=C(C=C1)NS(=O)(=O)C2=CC3=C(C=C2)OCC4=C3ON=C4)C

InChI

InChI=1S/C21H23N3O4S/c1-4-24(5-2)16-6-8-19(14(3)10-16)23-29(25,26)17-7-9-20-18(11-17)21-15(13-27-20)12-22-28-21/h6-12,23H,4-5,13H2,1-3H3