N-[1-[3-(2-azanyl-4-cyano-phenyl)propanoyl]-3,4-dihydro-2H-quinolin-6-yl]benzenesulfonamide

Systemtic Name: N-[1-[3-(2-azanyl-4-cyano-phenyl)propanoyl]-3,4-dihydro-2H-quinolin-6-yl]benzenesulfonamide Openeye Name: N-[1-[3-(2-amino-4-cyano-phenyl)propanoyl]-3,4-dihydro-2H-quinolin-6-yl]benzenesulfonamide CAS Name: N-[1-[3-(2-amino-4-cyanophenyl)-1-oxopropyl]-3,4-dihydro-2H-quinolin-6-yl]benzenesulfonamide IUPAC Name: N-[1-[3-(2-amino-4-cyanophenyl)propanoyl]-3,4-dihydro-2H-quinolin-6-yl]benzenesulfonamide Traditional Name: N-[1-[3-(2-amino-4-cyano-phenyl)propanoyl]-3,4-dihydro-2H-quinolin-6-yl]benzenesulfonamide Formula: C25H24N4O3S MolecularWeight: 460.54806

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C=CC(=C2)NS(=O)(=O)C3=CC=CC=C3)N(C1)C(=O)CCC4=C(C=C(C=C4)C#N)N

Isomeric SMILES

C1CC2=C(C=CC(=C2)NS(=O)(=O)C3=CC=CC=C3)N(C1)C(=O)CCC4=C(C=C(C=C4)C#N)N

InChI

InChI=1S/C25H24N4O3S/c26-17-18-8-9-19(23(27)15-18)10-13-25(30)29-14-4-5-20-16-21(11-12-24(20)29)28-33(31,32)22-6-2-1-3-7-22/h1-3,6-9,11-12,15-16,28H,4-5,10,13-14,27H2