N-[1-[3-(4-cyanophenyl)propanoyl]-3,4-dihydro-2H-quinolin-6-yl]propane-1-sulfonamide

Systemtic Name: N-[1-[3-(4-cyanophenyl)propanoyl]-3,4-dihydro-2H-quinolin-6-yl]propane-1-sulfonamide Openeye Name: N-[1-[3-(4-cyanophenyl)propanoyl]-3,4-dihydro-2H-quinolin-6-yl]propane-1-sulfonamide CAS Name: N-[1-[3-(4-cyanophenyl)-1-oxopropyl]-3,4-dihydro-2H-quinolin-6-yl]-1-propanesulfonamide IUPAC Name: N-[1-[3-(4-cyanophenyl)propanoyl]-3,4-dihydro-2H-quinolin-6-yl]propane-1-sulfonamide Traditional Name: N-[1-[3-(4-cyanophenyl)propanoyl]-3,4-dihydro-2H-quinolin-6-yl]propane-1-sulfonamide Formula: C22H25N3O3S MolecularWeight: 411.5172

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Descriptors Computed from Structure

Canonical SMILES:

CCCS(=O)(=O)NC1=CC2=C(C=C1)N(CCC2)C(=O)CCC3=CC=C(C=C3)C#N

Isomeric SMILES

CCCS(=O)(=O)NC1=CC2=C(C=C1)N(CCC2)C(=O)CCC3=CC=C(C=C3)C#N

InChI

InChI=1S/C22H25N3O3S/c1-2-14-29(27,28)24-20-10-11-21-19(15-20)4-3-13-25(21)22(26)12-9-17-5-7-18(16-23)8-6-17/h5-8,10-11,15,24H,2-4,9,12-14H2,1H3