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

Systemtic Name: N-[1-[(3-cyanophenyl)methyl]piperidin-4-yl]-N-(cyclopropylmethyl)quinoline-8-sulfonamide Openeye Name: N-[1-[(3-cyanophenyl)methyl]-4-piperidyl]-N-(cyclopropylmethyl)quinoline-8-sulfonamide CAS Name: N-[1-[(3-cyanophenyl)methyl]-4-piperidinyl]-N-(cyclopropylmethyl)-8-quinolinesulfonamide IUPAC Name: N-[1-[(3-cyanophenyl)methyl]piperidin-4-yl]-N-(cyclopropylmethyl)quinoline-8-sulfonamide Traditional Name: N-[1-(3-cyanobenzyl)-4-piperidyl]-N-(cyclopropylmethyl)quinoline-8-sulfonamide Formula: C26H28N4O2S MolecularWeight: 460.59112

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1CN(C2CCN(CC2)CC3=CC=CC(=C3)C#N)S(=O)(=O)C4=CC=CC5=C4N=CC=C5

Isomeric SMILES

C1CC1CN(C2CCN(CC2)CC3=CC=CC(=C3)C#N)S(=O)(=O)C4=CC=CC5=C4N=CC=C5

InChI

InChI=1S/C26H28N4O2S/c27-17-21-4-1-5-22(16-21)18-29-14-11-24(12-15-29)30(19-20-9-10-20)33(31,32)25-8-2-6-23-7-3-13-28-26(23)25/h1-8,13,16,20,24H,9-12,14-15,18-19H2