3-[[4-[3-(oxolan-2-yl)-2,1-benzoxazol-5-yl]pyrimidin-2-yl]amino]benzenesulfonamide

Systemtic Name: 3-[[4-[3-(oxolan-2-yl)-2,1-benzoxazol-5-yl]pyrimidin-2-yl]amino]benzenesulfonamide Openeye Name: 3-[[4-(3-tetrahydrofuran-2-yl-2,1-benzoxazol-5-yl)pyrimidin-2-yl]amino]benzenesulfonamide CAS Name: 3-[[4-[3-(2-oxolanyl)-2,1-benzoxazol-5-yl]-2-pyrimidinyl]amino]benzenesulfonamide IUPAC Name: 3-[[4-[3-(oxolan-2-yl)-2,1-benzoxazol-5-yl]pyrimidin-2-yl]amino]benzenesulfonamide Traditional Name: 3-[[4-[3-(tetrahydrofuryl)anthranil-5-yl]pyrimidin-2-yl]amino]benzenesulfonamide Formula: C21H19N5O4S MolecularWeight: 437.47166

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)C2=C3C=C(C=CC3=NO2)C4=NC(=NC=C4)NC5=CC(=CC=C5)S(=O)(=O)N

Isomeric SMILES

C1CC(OC1)C2=C3C=C(C=CC3=NO2)C4=NC(=NC=C4)NC5=CC(=CC=C5)S(=O)(=O)N

InChI

InChI=1S/C21H19N5O4S/c22-31(27,28)15-4-1-3-14(12-15)24-21-23-9-8-17(25-21)13-6-7-18-16(11-13)20(30-26-18)19-5-2-10-29-19/h1,3-4,6-9,11-12,19H,2,5,10H2,(H2,22,27,28)(H,23,24,25)