N-[2-[6-(azepan-1-yl)pyrimidin-4-yl]oxyethyl]-4-fluoranyl-3-methyl-benzenesulfonamide

Systemtic Name: N-[2-[6-(azepan-1-yl)pyrimidin-4-yl]oxyethyl]-4-fluoranyl-3-methyl-benzenesulfonamide Openeye Name: N-[2-[6-(azepan-1-yl)pyrimidin-4-yl]oxyethyl]-4-fluoro-3-methyl-benzenesulfonamide CAS Name: N-[2-[[6-(1-azepanyl)-4-pyrimidinyl]oxy]ethyl]-4-fluoro-3-methylbenzenesulfonamide IUPAC Name: N-[2-[6-(azepan-1-yl)pyrimidin-4-yl]oxyethyl]-4-fluoro-3-methylbenzenesulfonamide Traditional Name: N-[2-[6-(azepan-1-yl)pyrimidin-4-yl]oxyethyl]-4-fluoro-3-methyl-benzenesulfonamide Formula: C19H25FN4O3S MolecularWeight: 408.490203

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)S(=O)(=O)NCCOC2=NC=NC(=C2)N3CCCCCC3)F

Isomeric SMILES

CC1=C(C=CC(=C1)S(=O)(=O)NCCOC2=NC=NC(=C2)N3CCCCCC3)F

InChI

InChI=1S/C19H25FN4O3S/c1-15-12-16(6-7-17(15)20)28(25,26)23-8-11-27-19-13-18(21-14-22-19)24-9-4-2-3-5-10-24/h6-7,12-14,23H,2-5,8-11H2,1H3