2-[2-[4-[[3,5-bis(trifluoromethyloxy)phenyl]methylamino]-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl]ethoxy]ethanoic acid

Systemtic Name: 2-[2-[4-[[3,5-bis(trifluoromethyloxy)phenyl]methylamino]-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl]ethoxy]ethanoic acid Openeye Name: 2-[2-[4-[[3,5-bis(trifluoromethoxy)phenyl]methylamino]-5,6,7,8-tetrahydrobenzothiopheno[2,3-d]pyrimidin-2-yl]ethoxy]acetic acid CAS Name: 2-[2-[4-[[3,5-bis(trifluoromethoxy)phenyl]methylamino]-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl]ethoxy]acetic acid IUPAC Name: 2-[2-[4-[[3,5-bis(trifluoromethoxy)phenyl]methylamino]-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl]ethoxy]acetic acid Traditional Name: 2-[2-[4-[[3,5-bis(trifluoromethoxy)benzyl]amino]-5,6,7,8-tetrahydrobenzothiopheno[2,3-d]pyrimidin-2-yl]ethoxy]acetic acid Formula: C23H21F6N3O5S MolecularWeight: 565.485359

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C3=C(N=C(N=C3S2)CCOCC(=O)O)NCC4=CC(=CC(=C4)OC(F)(F)F)OC(F)(F)F

Isomeric SMILES

C1CCC2=C(C1)C3=C(N=C(N=C3S2)CCOCC(=O)O)NCC4=CC(=CC(=C4)OC(F)(F)F)OC(F)(F)F

InChI

InChI=1S/C23H21F6N3O5S/c24-22(25,26)36-13-7-12(8-14(9-13)37-23(27,28)29)10-30-20-19-15-3-1-2-4-16(15)38-21(19)32-17(31-20)5-6-35-11-18(33)34/h7-9H,1-6,10-11H2,(H,33,34)(H,30,31,32)