2-[2-chloranyl-4-fluoranyl-5-[(6-methyl-5,6,7,7a-tetrahydro-1H-pyrrolo[2,1-c][1,2,4]thiadiazol-3-ylidene)amino]phenyl]sulfanylethanoic acid

Systemtic Name: 2-[2-chloranyl-4-fluoranyl-5-[(6-methyl-5,6,7,7a-tetrahydro-1H-pyrrolo[2,1-c][1,2,4]thiadiazol-3-ylidene)amino]phenyl]sulfanylethanoic acid Openeye Name: 2-[2-chloro-4-fluoro-5-[(6-methyl-5,6,7,7a-tetrahydro-1H-pyrrolo[2,1-c][1,2,4]thiadiazol-3-ylidene)amino]phenyl]sulfanylacetic acid CAS Name: 2-[[2-chloro-4-fluoro-5-[(6-methyl-5,6,7,7a-tetrahydro-1H-pyrrolo[2,1-c][1,2,4]thiadiazol-3-ylidene)amino]phenyl]thio]acetic acid IUPAC Name: 2-[2-chloro-4-fluoro-5-[(6-methyl-5,6,7,7a-tetrahydro-1H-pyrrolo[2,1-c][1,2,4]thiadiazol-3-ylidene)amino]phenyl]sulfanylacetic acid Traditional Name: 2-[[2-chloro-4-fluoro-5-[(6-methyl-5,6,7,7a-tetrahydro-1H-pyrrolo[2,1-c][1,2,4]thiadiazol-3-ylidene)amino]phenyl]thio]acetic acid Formula: C14H15ClFN3O2S2 MolecularWeight: 375.869203

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC2NSC(=NC3=CC(=C(C=C3F)Cl)SCC(=O)O)N2C1

Isomeric SMILES

CC1CC2NSC(=NC3=CC(=C(C=C3F)Cl)SCC(=O)O)N2C1

InChI

InChI=1S/C14H15ClFN3O2S2/c1-7-2-12-18-23-14(19(12)5-7)17-10-4-11(22-6-13(20)21)8(15)3-9(10)16/h3-4,7,12,18H,2,5-6H2,1H3,(H,20,21)