[2-[2,4-bis(fluoranyl)phenyl]-3-[4-(4-cyanophenyl)-1,3-thiazol-2-yl]-1-(1,2,4-triazol-1-yl)butan-2-yl] 2-chloroethyl carbonate

Systemtic Name: [2-[2,4-bis(fluoranyl)phenyl]-3-[4-(4-cyanophenyl)-1,3-thiazol-2-yl]-1-(1,2,4-triazol-1-yl)butan-2-yl] 2-chloroethyl carbonate Openeye Name: 2-chloroethyl [2-[4-(4-cyanophenyl)thiazol-2-yl]-1-(2,4-difluorophenyl)-1-(1,2,4-triazol-1-ylmethyl)propyl] carbonate CAS Name: carbonic acid 2-chloroethyl [3-[4-(4-cyanophenyl)-2-thiazolyl]-2-(2,4-difluorophenyl)-1-(1,2,4-triazol-1-yl)butan-2-yl] ester IUPAC Name: 2-chloroethyl [3-[4-(4-cyanophenyl)-1,3-thiazol-2-yl]-2-(2,4-difluorophenyl)-1-(1,2,4-triazol-1-yl)butan-2-yl] carbonate Traditional Name: carbonic acid 2-chloroethyl [2-[4-(4-cyanophenyl)thiazol-2-yl]-1-(2,4-difluorophenyl)-1-(1,2,4-triazol-1-ylmethyl)propyl] ester Formula: C25H20ClF2N5O3S MolecularWeight: 543.972806

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NC(=CS1)C2=CC=C(C=C2)C#N)C(CN3C=NC=N3)(C4=C(C=C(C=C4)F)F)OC(=O)OCCCl

Isomeric SMILES

CC(C1=NC(=CS1)C2=CC=C(C=C2)C#N)C(CN3C=NC=N3)(C4=C(C=C(C=C4)F)F)OC(=O)OCCCl

InChI

InChI=1S/C25H20ClF2N5O3S/c1-16(23-32-22(12-37-23)18-4-2-17(11-29)3-5-18)25(13-33-15-30-14-31-33,36-24(34)35-9-8-26)20-7-6-19(27)10-21(20)28/h2-7,10,12,14-16H,8-9,13H2,1H3