4-[[2-azanyl-6-(5-chloranyl-2-ethoxy-phenyl)pyrimidin-4-yl]amino]benzenesulfonamide

Systemtic Name: 4-[[2-azanyl-6-(5-chloranyl-2-ethoxy-phenyl)pyrimidin-4-yl]amino]benzenesulfonamide Openeye Name: 4-[[2-amino-6-(5-chloro-2-ethoxy-phenyl)pyrimidin-4-yl]amino]benzenesulfonamide CAS Name: 4-[[2-amino-6-(5-chloro-2-ethoxyphenyl)-4-pyrimidinyl]amino]benzenesulfonamide IUPAC Name: 4-[[2-amino-6-(5-chloro-2-ethoxyphenyl)pyrimidin-4-yl]amino]benzenesulfonamide Traditional Name: 4-[[2-amino-6-(5-chloro-2-ethoxy-phenyl)pyrimidin-4-yl]amino]benzenesulfonamide Formula: C18H18ClN5O3S MolecularWeight: 419.88522

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)Cl)C2=CC(=NC(=N2)N)NC3=CC=C(C=C3)S(=O)(=O)N

Isomeric SMILES

CCOC1=C(C=C(C=C1)Cl)C2=CC(=NC(=N2)N)NC3=CC=C(C=C3)S(=O)(=O)N

InChI

InChI=1S/C18H18ClN5O3S/c1-2-27-16-8-3-11(19)9-14(16)15-10-17(24-18(20)23-15)22-12-4-6-13(7-5-12)28(21,25)26/h3-10H,2H2,1H3,(H2,21,25,26)(H3,20,22,23,24)