N-[6-methyl-2-oxidanylidene-1-[3-(quinolin-4-ylamino)propyl]pyridin-3-yl]-1-phenyl-methanesulfonamide

Systemtic Name: N-[6-methyl-2-oxidanylidene-1-[3-(quinolin-4-ylamino)propyl]pyridin-3-yl]-1-phenyl-methanesulfonamide Openeye Name: N-[6-methyl-2-oxo-1-[3-(4-quinolylamino)propyl]-3-pyridyl]-1-phenyl-methanesulfonamide CAS Name: N-[6-methyl-2-oxo-1-[3-(4-quinolinylamino)propyl]-3-pyridinyl]-1-phenylmethanesulfonamide IUPAC Name: N-[6-methyl-2-oxo-1-[3-(quinolin-4-ylamino)propyl]pyridin-3-yl]-1-phenylmethanesulfonamide Traditional Name: N-[2-keto-6-methyl-1-[3-(4-quinolylamino)propyl]-3-pyridyl]-1-phenyl-methanesulfonamide Formula: C25H26N4O3S MolecularWeight: 462.56394

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C(=O)N1CCCNC2=CC=NC3=CC=CC=C32)NS(=O)(=O)CC4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C(=O)N1CCCNC2=CC=NC3=CC=CC=C32)NS(=O)(=O)CC4=CC=CC=C4

InChI

InChI=1S/C25H26N4O3S/c1-19-12-13-24(28-33(31,32)18-20-8-3-2-4-9-20)25(30)29(19)17-7-15-26-23-14-16-27-22-11-6-5-10-21(22)23/h2-6,8-14,16,28H,7,15,17-18H2,1H3,(H,26,27)