N-methyl-1-[3-(1-quinolin-8-ylsulfonylpiperidin-4-yl)oxyphenyl]-N-(thiophen-2-ylmethyl)methanamine

Systemtic Name: N-methyl-1-[3-(1-quinolin-8-ylsulfonylpiperidin-4-yl)oxyphenyl]-N-(thiophen-2-ylmethyl)methanamine Openeye Name: N-methyl-1-[3-[[1-(8-quinolylsulfonyl)-4-piperidyl]oxy]phenyl]-N-(2-thienylmethyl)methanamine CAS Name: N-methyl-1-[3-[[1-(8-quinolinylsulfonyl)-4-piperidinyl]oxy]phenyl]-N-(thiophen-2-ylmethyl)methanamine IUPAC Name: N-methyl-1-[3-(1-quinolin-8-ylsulfonylpiperidin-4-yl)oxyphenyl]-N-(thiophen-2-ylmethyl)methanamine Traditional Name: methyl-[3-[[1-(8-quinolylsulfonyl)-4-piperidyl]oxy]benzyl]-(2-thenyl)amine Formula: C27H29N3O3S2 MolecularWeight: 507.66746

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC(=CC=C1)OC2CCN(CC2)S(=O)(=O)C3=CC=CC4=C3N=CC=C4)CC5=CC=CS5

Isomeric SMILES

CN(CC1=CC(=CC=C1)OC2CCN(CC2)S(=O)(=O)C3=CC=CC4=C3N=CC=C4)CC5=CC=CS5

InChI

InChI=1S/C27H29N3O3S2/c1-29(20-25-10-5-17-34-25)19-21-6-2-9-24(18-21)33-23-12-15-30(16-13-23)35(31,32)26-11-3-7-22-8-4-14-28-27(22)26/h2-11,14,17-18,23H,12-13,15-16,19-20H2,1H3