2-[[4-[(5-chloranyl-1,3-benzodioxol-4-yl)amino]pyrimidin-2-yl]amino]benzenesulfonamide

Systemtic Name: 2-[[4-[(5-chloranyl-1,3-benzodioxol-4-yl)amino]pyrimidin-2-yl]amino]benzenesulfonamide Openeye Name: 2-[[4-[(5-chloro-1,3-benzodioxol-4-yl)amino]pyrimidin-2-yl]amino]benzenesulfonamide CAS Name: 2-[[4-[(5-chloro-1,3-benzodioxol-4-yl)amino]-2-pyrimidinyl]amino]benzenesulfonamide IUPAC Name: 2-[[4-[(5-chloro-1,3-benzodioxol-4-yl)amino]pyrimidin-2-yl]amino]benzenesulfonamide Traditional Name: 2-[[4-[(5-chloro-1,3-benzodioxol-4-yl)amino]pyrimidin-2-yl]amino]benzenesulfonamide Formula: C17H14ClN5O4S MolecularWeight: 419.84216

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C(=C(C=C2)Cl)NC3=NC(=NC=C3)NC4=CC=CC=C4S(=O)(=O)N

Isomeric SMILES

C1OC2=C(O1)C(=C(C=C2)Cl)NC3=NC(=NC=C3)NC4=CC=CC=C4S(=O)(=O)N

InChI

InChI=1S/C17H14ClN5O4S/c18-10-5-6-12-16(27-9-26-12)15(10)22-14-7-8-20-17(23-14)21-11-3-1-2-4-13(11)28(19,24)25/h1-8H,9H2,(H2,19,24,25)(H2,20,21,22,23)