N-[[(3R)-1-[(4-propan-2-yl-1,3-thiazol-2-yl)methyl]piperidin-3-yl]methyl]quinoline-8-sulfonamide

Systemtic Name: N-[[(3R)-1-[(4-propan-2-yl-1,3-thiazol-2-yl)methyl]piperidin-3-yl]methyl]quinoline-8-sulfonamide Openeye Name: N-[[(3R)-1-[(4-isopropylthiazol-2-yl)methyl]-3-piperidyl]methyl]quinoline-8-sulfonamide CAS Name: N-[[(3R)-1-[(4-propan-2-yl-2-thiazolyl)methyl]-3-piperidinyl]methyl]-8-quinolinesulfonamide IUPAC Name: N-[[(3R)-1-[(4-propan-2-yl-1,3-thiazol-2-yl)methyl]piperidin-3-yl]methyl]quinoline-8-sulfonamide Traditional Name: N-[[(3R)-1-[(4-isopropylthiazol-2-yl)methyl]-3-piperidyl]methyl]quinoline-8-sulfonamide Formula: C22H28N4O2S2 MolecularWeight: 444.61332

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CSC(=N1)CN2CCCC(C2)CNS(=O)(=O)C3=CC=CC4=C3N=CC=C4

Isomeric SMILES

CC(C)C1=CSC(=N1)CN2CCC[C@H](C2)CNS(=O)(=O)C3=CC=CC4=C3N=CC=C4

InChI

InChI=1S/C22H28N4O2S2/c1-16(2)19-15-29-21(25-19)14-26-11-5-6-17(13-26)12-24-30(27,28)20-9-3-7-18-8-4-10-23-22(18)20/h3-4,7-10,15-17,24H,5-6,11-14H2,1-2H3/t17-/m0/s1