5-bromanyl-2-ethoxy-N-[2-(6-pyrrolidin-1-ylpyrimidin-4-yl)oxyethyl]benzenesulfonamide

Systemtic Name: 5-bromanyl-2-ethoxy-N-[2-(6-pyrrolidin-1-ylpyrimidin-4-yl)oxyethyl]benzenesulfonamide Openeye Name: 5-bromo-2-ethoxy-N-[2-(6-pyrrolidin-1-ylpyrimidin-4-yl)oxyethyl]benzenesulfonamide CAS Name: 5-bromo-2-ethoxy-N-[2-[[6-(1-pyrrolidinyl)-4-pyrimidinyl]oxy]ethyl]benzenesulfonamide IUPAC Name: 5-bromo-2-ethoxy-N-[2-(6-pyrrolidin-1-ylpyrimidin-4-yl)oxyethyl]benzenesulfonamide Traditional Name: 5-bromo-2-ethoxy-N-[2-(6-pyrrolidinopyrimidin-4-yl)oxyethyl]benzenesulfonamide Formula: C18H23BrN4O4S MolecularWeight: 471.36862

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)Br)S(=O)(=O)NCCOC2=NC=NC(=C2)N3CCCC3

Isomeric SMILES

CCOC1=C(C=C(C=C1)Br)S(=O)(=O)NCCOC2=NC=NC(=C2)N3CCCC3

InChI

InChI=1S/C18H23BrN4O4S/c1-2-26-15-6-5-14(19)11-16(15)28(24,25)22-7-10-27-18-12-17(20-13-21-18)23-8-3-4-9-23/h5-6,11-13,22H,2-4,7-10H2,1H3