1-[3-[5-[2,5-bis(fluoranyl)phenyl]-3-ethanoyl-2-phenyl-1,3,4-thiadiazol-2-yl]propyl]-3-cyano-2-methyl-guanidine

Systemtic Name: 1-[3-[5-[2,5-bis(fluoranyl)phenyl]-3-ethanoyl-2-phenyl-1,3,4-thiadiazol-2-yl]propyl]-3-cyano-2-methyl-guanidine Openeye Name: 1-[3-[3-acetyl-5-(2,5-difluorophenyl)-2-phenyl-1,3,4-thiadiazol-2-yl]propyl]-3-cyano-2-methyl-guanidine CAS Name: 1-[3-[3-acetyl-5-(2,5-difluorophenyl)-2-phenyl-1,3,4-thiadiazol-2-yl]propyl]-3-cyano-2-methylguanidine IUPAC Name: 1-[3-[3-acetyl-5-(2,5-difluorophenyl)-2-phenyl-1,3,4-thiadiazol-2-yl]propyl]-3-cyano-2-methylguanidine Traditional Name: 1-[3-[3-acetyl-5-(2,5-difluorophenyl)-2-phenyl-1,3,4-thiadiazol-2-yl]propyl]-3-cyano-2-methyl-guanidine Formula: C22H22F2N6OS MolecularWeight: 456.511486

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1C(SC(=N1)C2=C(C=CC(=C2)F)F)(CCCNC(=NC)NC#N)C3=CC=CC=C3

Isomeric SMILES

CC(=O)N1C(SC(=N1)C2=C(C=CC(=C2)F)F)(CCCNC(=NC)NC#N)C3=CC=CC=C3

InChI

InChI=1S/C22H22F2N6OS/c1-15(31)30-22(16-7-4-3-5-8-16,11-6-12-27-21(26-2)28-14-25)32-20(29-30)18-13-17(23)9-10-19(18)24/h3-5,7-10,13H,6,11-12H2,1-2H3,(H2,26,27,28)