N-[2-[2-[(3-piperidin-1-ylcarbonylphenyl)methylamino]ethylamino]phenyl]methanesulfonamide

Systemtic Name: N-[2-[2-[(3-piperidin-1-ylcarbonylphenyl)methylamino]ethylamino]phenyl]methanesulfonamide Openeye Name: N-[2-[2-[[3-(piperidine-1-carbonyl)phenyl]methylamino]ethylamino]phenyl]methanesulfonamide CAS Name: N-[2-[2-[[3-[oxo(1-piperidinyl)methyl]phenyl]methylamino]ethylamino]phenyl]methanesulfonamide IUPAC Name: N-[2-[2-[[3-(piperidine-1-carbonyl)phenyl]methylamino]ethylamino]phenyl]methanesulfonamide Traditional Name: N-[2-[2-[[3-(piperidine-1-carbonyl)benzyl]amino]ethylamino]phenyl]methanesulfonamide Formula: C22H30N4O3S MolecularWeight: 430.5636

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)NC1=CC=CC=C1NCCNCC2=CC=CC(=C2)C(=O)N3CCCCC3

Isomeric SMILES

CS(=O)(=O)NC1=CC=CC=C1NCCNCC2=CC=CC(=C2)C(=O)N3CCCCC3

InChI

InChI=1S/C22H30N4O3S/c1-30(28,29)25-21-11-4-3-10-20(21)24-13-12-23-17-18-8-7-9-19(16-18)22(27)26-14-5-2-6-15-26/h3-4,7-11,16,23-25H,2,5-6,12-15,17H2,1H3