2-[4-[4-[2-[[1-[4-tert-butyl-2,6-bis(chloranyl)phenyl]-1,2,3,4-tetrazol-5-yl]sulfanyl]ethanoylamino]-3-chloranyl-phenyl]phenoxy]ethanoic acid

Systemtic Name: 2-[4-[4-[2-[[1-[4-tert-butyl-2,6-bis(chloranyl)phenyl]-1,2,3,4-tetrazol-5-yl]sulfanyl]ethanoylamino]-3-chloranyl-phenyl]phenoxy]ethanoic acid Openeye Name: 2-[4-[4-[[2-[1-(4-tert-butyl-2,6-dichloro-phenyl)tetrazol-5-yl]sulfanylacetyl]amino]-3-chloro-phenyl]phenoxy]acetic acid CAS Name: 2-[4-[4-[[2-[[1-(4-tert-butyl-2,6-dichlorophenyl)-5-tetrazolyl]thio]-1-oxoethyl]amino]-3-chlorophenyl]phenoxy]acetic acid IUPAC Name: 2-[4-[4-[[2-[1-(4-tert-butyl-2,6-dichlorophenyl)tetrazol-5-yl]sulfanylacetyl]amino]-3-chlorophenyl]phenoxy]acetic acid Traditional Name: 2-[4-[4-[[2-[[1-(4-tert-butyl-2,6-dichloro-phenyl)tetrazol-5-yl]thio]acetyl]amino]-3-chloro-phenyl]phenoxy]acetic acid Formula: C27H24Cl3N5O4S MolecularWeight: 620.93456

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=C(C(=C1)Cl)N2C(=NN=N2)SCC(=O)NC3=C(C=C(C=C3)C4=CC=C(C=C4)OCC(=O)O)Cl)Cl

Isomeric SMILES

CC(C)(C)C1=CC(=C(C(=C1)Cl)N2C(=NN=N2)SCC(=O)NC3=C(C=C(C=C3)C4=CC=C(C=C4)OCC(=O)O)Cl)Cl

InChI

InChI=1S/C27H24Cl3N5O4S/c1-27(2,3)17-11-20(29)25(21(30)12-17)35-26(32-33-34-35)40-14-23(36)31-22-9-6-16(10-19(22)28)15-4-7-18(8-5-15)39-13-24(37)38/h4-12H,13-14H2,1-3H3,(H,31,36)(H,37,38)