N-(phenylmethyl)-3-piperidin-1-ylcarbonyl-4-(pyridin-4-ylamino)benzenesulfonamide

Systemtic Name: N-(phenylmethyl)-3-piperidin-1-ylcarbonyl-4-(pyridin-4-ylamino)benzenesulfonamide Openeye Name: N-benzyl-3-(piperidine-1-carbonyl)-4-(4-pyridylamino)benzenesulfonamide CAS Name: 3-[oxo(1-piperidinyl)methyl]-N-(phenylmethyl)-4-(pyridin-4-ylamino)benzenesulfonamide IUPAC Name: N-benzyl-3-(piperidine-1-carbonyl)-4-(pyridin-4-ylamino)benzenesulfonamide Traditional Name: N-benzyl-3-(piperidine-1-carbonyl)-4-(4-pyridylamino)benzenesulfonamide Formula: C24H26N4O3S MolecularWeight: 450.55324

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)C2=C(C=CC(=C2)S(=O)(=O)NCC3=CC=CC=C3)NC4=CC=NC=C4

Isomeric SMILES

C1CCN(CC1)C(=O)C2=C(C=CC(=C2)S(=O)(=O)NCC3=CC=CC=C3)NC4=CC=NC=C4

InChI

InChI=1S/C24H26N4O3S/c29-24(28-15-5-2-6-16-28)22-17-21(9-10-23(22)27-20-11-13-25-14-12-20)32(30,31)26-18-19-7-3-1-4-8-19/h1,3-4,7-14,17,26H,2,5-6,15-16,18H2,(H,25,27)