N,N-diethyl-4-(2-phenylsulfanylpyridin-3-yl)carbonyl-piperazine-1-sulfonamide

Systemtic Name: N,N-diethyl-4-(2-phenylsulfanylpyridin-3-yl)carbonyl-piperazine-1-sulfonamide Openeye Name: N,N-diethyl-4-(2-phenylsulfanylpyridine-3-carbonyl)piperazine-1-sulfonamide CAS Name: N,N-diethyl-4-[oxo-[2-(phenylthio)-3-pyridinyl]methyl]-1-piperazinesulfonamide IUPAC Name: N,N-diethyl-4-(2-phenylsulfanylpyridine-3-carbonyl)piperazine-1-sulfonamide Traditional Name: N,N-diethyl-4-[2-(phenylthio)nicotinoyl]piperazine-1-sulfonamide Formula: C20H26N4O3S2 MolecularWeight: 434.57544

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)N1CCN(CC1)C(=O)C2=C(N=CC=C2)SC3=CC=CC=C3

Isomeric SMILES

CCN(CC)S(=O)(=O)N1CCN(CC1)C(=O)C2=C(N=CC=C2)SC3=CC=CC=C3

InChI

InChI=1S/C20H26N4O3S2/c1-3-23(4-2)29(26,27)24-15-13-22(14-16-24)20(25)18-11-8-12-21-19(18)28-17-9-6-5-7-10-17/h5-12H,3-4,13-16H2,1-2H3