N-[1-[2-azanyl-3-(1-benzothiophen-3-yl)propanoyl]piperidin-4-yl]-N-propan-2-yl-3-(trifluoromethyl)benzenesulfonamide

Systemtic Name: N-[1-[2-azanyl-3-(1-benzothiophen-3-yl)propanoyl]piperidin-4-yl]-N-propan-2-yl-3-(trifluoromethyl)benzenesulfonamide Openeye Name: N-[1-[2-amino-3-(benzothiophen-3-yl)propanoyl]-4-piperidyl]-N-isopropyl-3-(trifluoromethyl)benzenesulfonamide CAS Name: N-[1-[2-amino-3-(1-benzothiophen-3-yl)-1-oxopropyl]-4-piperidinyl]-N-propan-2-yl-3-(trifluoromethyl)benzenesulfonamide IUPAC Name: N-[1-[2-amino-3-(1-benzothiophen-3-yl)propanoyl]piperidin-4-yl]-N-propan-2-yl-3-(trifluoromethyl)benzenesulfonamide Traditional Name: N-[1-[2-amino-3-(benzothiophen-3-yl)propanoyl]-4-piperidyl]-N-isopropyl-3-(trifluoromethyl)benzenesulfonamide Formula: C26H30F3N3O3S2 MolecularWeight: 553.65991

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(C1CCN(CC1)C(=O)C(CC2=CSC3=CC=CC=C32)N)S(=O)(=O)C4=CC=CC(=C4)C(F)(F)F

Isomeric SMILES

CC(C)N(C1CCN(CC1)C(=O)C(CC2=CSC3=CC=CC=C32)N)S(=O)(=O)C4=CC=CC(=C4)C(F)(F)F

InChI

InChI=1S/C26H30F3N3O3S2/c1-17(2)32(37(34,35)21-7-5-6-19(15-21)26(27,28)29)20-10-12-31(13-11-20)25(33)23(30)14-18-16-36-24-9-4-3-8-22(18)24/h3-9,15-17,20,23H,10-14,30H2,1-2H3