1-[2-[3-chloranyl-4-[2-[[1-(2-chloranyl-4-cyclopropyl-phenyl)-1,2,3,4-tetrazol-5-yl]sulfanyl]ethanoylamino]phenyl]ethynyl]cyclopropane-1-carboxylic acid

Systemtic Name: 1-[2-[3-chloranyl-4-[2-[[1-(2-chloranyl-4-cyclopropyl-phenyl)-1,2,3,4-tetrazol-5-yl]sulfanyl]ethanoylamino]phenyl]ethynyl]cyclopropane-1-carboxylic acid Openeye Name: 1-[2-[3-chloro-4-[[2-[1-(2-chloro-4-cyclopropyl-phenyl)tetrazol-5-yl]sulfanylacetyl]amino]phenyl]ethynyl]cyclopropanecarboxylic acid CAS Name: 1-[2-[3-chloro-4-[[2-[[1-(2-chloro-4-cyclopropylphenyl)-5-tetrazolyl]thio]-1-oxoethyl]amino]phenyl]ethynyl]-1-cyclopropanecarboxylic acid IUPAC Name: 1-[2-[3-chloro-4-[[2-[1-(2-chloro-4-cyclopropylphenyl)tetrazol-5-yl]sulfanylacetyl]amino]phenyl]ethynyl]cyclopropane-1-carboxylic acid Traditional Name: 1-[2-[3-chloro-4-[[2-[[1-(2-chloro-4-cyclopropyl-phenyl)tetrazol-5-yl]thio]acetyl]amino]phenyl]ethynyl]cyclopropanecarboxylic acid Formula: C24H19Cl2N5O3S MolecularWeight: 528.41036

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C2=CC(=C(C=C2)N3C(=NN=N3)SCC(=O)NC4=C(C=C(C=C4)C#CC5(CC5)C(=O)O)Cl)Cl

Isomeric SMILES

C1CC1C2=CC(=C(C=C2)N3C(=NN=N3)SCC(=O)NC4=C(C=C(C=C4)C#CC5(CC5)C(=O)O)Cl)Cl

InChI

InChI=1S/C24H19Cl2N5O3S/c25-17-11-14(7-8-24(9-10-24)22(33)34)1-5-19(17)27-21(32)13-35-23-28-29-30-31(23)20-6-4-16(12-18(20)26)15-2-3-15/h1,4-6,11-12,15H,2-3,9-10,13H2,(H,27,32)(H,33,34)