N-[1-[(3-cyanophenyl)methyl]piperidin-4-yl]-N-phenethyl-quinoline-8-sulfonamide

Systemtic Name: N-[1-[(3-cyanophenyl)methyl]piperidin-4-yl]-N-phenethyl-quinoline-8-sulfonamide Openeye Name: N-[1-[(3-cyanophenyl)methyl]-4-piperidyl]-N-phenethyl-quinoline-8-sulfonamide CAS Name: N-[1-[(3-cyanophenyl)methyl]-4-piperidinyl]-N-phenethyl-8-quinolinesulfonamide IUPAC Name: N-[1-[(3-cyanophenyl)methyl]piperidin-4-yl]-N-phenethylquinoline-8-sulfonamide Traditional Name: N-[1-(3-cyanobenzyl)-4-piperidyl]-N-phenethyl-quinoline-8-sulfonamide Formula: C30H30N4O2S MolecularWeight: 510.6498

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1N(CCC2=CC=CC=C2)S(=O)(=O)C3=CC=CC4=C3N=CC=C4)CC5=CC=CC(=C5)C#N

Isomeric SMILES

C1CN(CCC1N(CCC2=CC=CC=C2)S(=O)(=O)C3=CC=CC4=C3N=CC=C4)CC5=CC=CC(=C5)C#N

InChI

InChI=1S/C30H30N4O2S/c31-22-25-9-4-10-26(21-25)23-33-18-15-28(16-19-33)34(20-14-24-7-2-1-3-8-24)37(35,36)29-13-5-11-27-12-6-17-32-30(27)29/h1-13,17,21,28H,14-16,18-20,23H2