4-(2-methylpropyl)-N-[2-oxidanylidene-4-(propylamino)chromen-3-yl]benzenesulfonamide

Systemtic Name: 4-(2-methylpropyl)-N-[2-oxidanylidene-4-(propylamino)chromen-3-yl]benzenesulfonamide Openeye Name: 4-isobutyl-N-[2-oxo-4-(propylamino)chromen-3-yl]benzenesulfonamide CAS Name: 4-(2-methylpropyl)-N-[2-oxo-4-(propylamino)-1-benzopyran-3-yl]benzenesulfonamide IUPAC Name: 4-(2-methylpropyl)-N-[2-oxo-4-(propylamino)chromen-3-yl]benzenesulfonamide Traditional Name: 4-isobutyl-N-[2-keto-4-(propylamino)chromen-3-yl]benzenesulfonamide Formula: C22H26N2O4S MolecularWeight: 414.51784

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC1=C(C(=O)OC2=CC=CC=C21)NS(=O)(=O)C3=CC=C(C=C3)CC(C)C

Isomeric SMILES

CCCNC1=C(C(=O)OC2=CC=CC=C21)NS(=O)(=O)C3=CC=C(C=C3)CC(C)C

InChI

InChI=1S/C22H26N2O4S/c1-4-13-23-20-18-7-5-6-8-19(18)28-22(25)21(20)24-29(26,27)17-11-9-16(10-12-17)14-15(2)3/h5-12,15,23-24H,4,13-14H2,1-3H3