N-(2-chloranyl-5-morpholin-4-ylsulfonyl-phenyl)-2-(4-fluorophenyl)sulfonyl-3,4-dihydro-1H-isoquinoline-3-carboxamide

Systemtic Name: N-(2-chloranyl-5-morpholin-4-ylsulfonyl-phenyl)-2-(4-fluorophenyl)sulfonyl-3,4-dihydro-1H-isoquinoline-3-carboxamide Openeye Name: N-(2-chloro-5-morpholinosulfonyl-phenyl)-2-(4-fluorophenyl)sulfonyl-3,4-dihydro-1H-isoquinoline-3-carboxamide CAS Name: N-[2-chloro-5-(4-morpholinylsulfonyl)phenyl]-2-(4-fluorophenyl)sulfonyl-3,4-dihydro-1H-isoquinoline-3-carboxamide IUPAC Name: N-(2-chloro-5-morpholin-4-ylsulfonylphenyl)-2-(4-fluorophenyl)sulfonyl-3,4-dihydro-1H-isoquinoline-3-carboxamide Traditional Name: N-(2-chloro-5-morpholinosulfonyl-phenyl)-2-(4-fluorophenyl)sulfonyl-3,4-dihydro-1H-isoquinoline-3-carboxamide Formula: C26H25ClFN3O6S2 MolecularWeight: 594.074603

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1S(=O)(=O)C2=CC(=C(C=C2)Cl)NC(=O)C3CC4=CC=CC=C4CN3S(=O)(=O)C5=CC=C(C=C5)F

Isomeric SMILES

C1COCCN1S(=O)(=O)C2=CC(=C(C=C2)Cl)NC(=O)C3CC4=CC=CC=C4CN3S(=O)(=O)C5=CC=C(C=C5)F

InChI

InChI=1S/C26H25ClFN3O6S2/c27-23-10-9-22(38(33,34)30-11-13-37-14-12-30)16-24(23)29-26(32)25-15-18-3-1-2-4-19(18)17-31(25)39(35,36)21-7-5-20(28)6-8-21/h1-10,16,25H,11-15,17H2,(H,29,32)