2,4-dimethyl-N-(2-methylpropyl)-N-[3-[[[(2S,3S)-2-phenylpiperidin-3-yl]amino]methyl]-4-propan-2-yloxy-phenyl]-1,3-thiazole-5-sulfonamide

Systemtic Name: 2,4-dimethyl-N-(2-methylpropyl)-N-[3-[[[(2S,3S)-2-phenylpiperidin-3-yl]amino]methyl]-4-propan-2-yloxy-phenyl]-1,3-thiazole-5-sulfonamide Openeye Name: N-isobutyl-N-[4-isopropoxy-3-[[[(2S,3S)-2-phenyl-3-piperidyl]amino]methyl]phenyl]-2,4-dimethyl-thiazole-5-sulfonamide CAS Name: 2,4-dimethyl-N-(2-methylpropyl)-N-[3-[[[(2S,3S)-2-phenyl-3-piperidinyl]amino]methyl]-4-propan-2-yloxyphenyl]-5-thiazolesulfonamide IUPAC Name: 2,4-dimethyl-N-(2-methylpropyl)-N-[3-[[[(2S,3S)-2-phenylpiperidin-3-yl]amino]methyl]-4-propan-2-yloxyphenyl]-1,3-thiazole-5-sulfonamide Traditional Name: N-isobutyl-N-[4-isopropoxy-3-[[[(2S,3S)-2-phenyl-3-piperidyl]amino]methyl]phenyl]-2,4-dimethyl-thiazole-5-sulfonamide Formula: C30H42N4O3S2 MolecularWeight: 570.80948

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)C)S(=O)(=O)N(CC(C)C)C2=CC(=C(C=C2)OC(C)C)CNC3CCCNC3C4=CC=CC=C4

Isomeric SMILES

CC1=C(SC(=N1)C)S(=O)(=O)N(CC(C)C)C2=CC(=C(C=C2)OC(C)C)CN[C@H]3CCCN[C@H]3C4=CC=CC=C4

InChI

InChI=1S/C30H42N4O3S2/c1-20(2)19-34(39(35,36)30-22(5)33-23(6)38-30)26-14-15-28(37-21(3)4)25(17-26)18-32-27-13-10-16-31-29(27)24-11-8-7-9-12-24/h7-9,11-12,14-15,17,20-21,27,29,31-32H,10,13,16,18-19H2,1-6H3/t27-,29-/m0/s1