2,4,6-trimethyl-N-[1-[(2-phenylazanylpyridin-3-yl)methyl]pyrrolidin-3-yl]benzenesulfonamide

Systemtic Name: 2,4,6-trimethyl-N-[1-[(2-phenylazanylpyridin-3-yl)methyl]pyrrolidin-3-yl]benzenesulfonamide Openeye Name: N-[1-[(2-anilino-3-pyridyl)methyl]pyrrolidin-3-yl]-2,4,6-trimethyl-benzenesulfonamide CAS Name: N-[1-[(2-anilino-3-pyridinyl)methyl]-3-pyrrolidinyl]-2,4,6-trimethylbenzenesulfonamide IUPAC Name: N-[1-[(2-anilinopyridin-3-yl)methyl]pyrrolidin-3-yl]-2,4,6-trimethylbenzenesulfonamide Traditional Name: N-[1-[(2-anilino-3-pyridyl)methyl]pyrrolidin-3-yl]-2,4,6-trimethyl-benzenesulfonamide Formula: C25H30N4O2S MolecularWeight: 450.5963

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)S(=O)(=O)NC2CCN(C2)CC3=C(N=CC=C3)NC4=CC=CC=C4)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)S(=O)(=O)NC2CCN(C2)CC3=C(N=CC=C3)NC4=CC=CC=C4)C

InChI

InChI=1S/C25H30N4O2S/c1-18-14-19(2)24(20(3)15-18)32(30,31)28-23-11-13-29(17-23)16-21-8-7-12-26-25(21)27-22-9-5-4-6-10-22/h4-10,12,14-15,23,28H,11,13,16-17H2,1-3H3,(H,26,27)