N-[2-chloranyl-3-cyano-4-[3-[(2-methyl-5-pyridin-3-yl-pentan-2-yl)amino]-2-oxidanyl-propoxy]phenyl]morpholine-4-sulfonamide

Systemtic Name: N-[2-chloranyl-3-cyano-4-[3-[(2-methyl-5-pyridin-3-yl-pentan-2-yl)amino]-2-oxidanyl-propoxy]phenyl]morpholine-4-sulfonamide Openeye Name: N-[2-chloro-3-cyano-4-[3-[[1,1-dimethyl-4-(3-pyridyl)butyl]amino]-2-hydroxy-propoxy]phenyl]morpholine-4-sulfonamide CAS Name: N-[2-chloro-3-cyano-4-[2-hydroxy-3-[[2-methyl-5-(3-pyridinyl)pentan-2-yl]amino]propoxy]phenyl]-4-morpholinesulfonamide IUPAC Name: N-[2-chloro-3-cyano-4-[2-hydroxy-3-[(2-methyl-5-pyridin-3-ylpentan-2-yl)amino]propoxy]phenyl]morpholine-4-sulfonamide Traditional Name: N-[2-chloro-3-cyano-4-[3-[[1,1-dimethyl-4-(3-pyridyl)butyl]amino]-2-hydroxy-propoxy]phenyl]morpholine-4-sulfonamide Formula: C25H34ClN5O5S MolecularWeight: 552.08596

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CCCC1=CN=CC=C1)NCC(COC2=C(C(=C(C=C2)NS(=O)(=O)N3CCOCC3)Cl)C#N)O

Isomeric SMILES

CC(C)(CCCC1=CN=CC=C1)NCC(COC2=C(C(=C(C=C2)NS(=O)(=O)N3CCOCC3)Cl)C#N)O

InChI

InChI=1S/C25H34ClN5O5S/c1-25(2,9-3-5-19-6-4-10-28-16-19)29-17-20(32)18-36-23-8-7-22(24(26)21(23)15-27)30-37(33,34)31-11-13-35-14-12-31/h4,6-8,10,16,20,29-30,32H,3,5,9,11-14,17-18H2,1-2H3