2-[[1-(4-tert-butyl-2-chloranyl-phenyl)-1,2,3,4-tetrazol-5-yl]sulfanyl]-N-[2-chloranyl-4-[2-(1-oxidanylcyclobutyl)ethynyl]phenyl]ethanamide

Systemtic Name: 2-[[1-(4-tert-butyl-2-chloranyl-phenyl)-1,2,3,4-tetrazol-5-yl]sulfanyl]-N-[2-chloranyl-4-[2-(1-oxidanylcyclobutyl)ethynyl]phenyl]ethanamide Openeye Name: 2-[1-(4-tert-butyl-2-chloro-phenyl)tetrazol-5-yl]sulfanyl-N-[2-chloro-4-[2-(1-hydroxycyclobutyl)ethynyl]phenyl]acetamide CAS Name: 2-[[1-(4-tert-butyl-2-chlorophenyl)-5-tetrazolyl]thio]-N-[2-chloro-4-[2-(1-hydroxycyclobutyl)ethynyl]phenyl]acetamide IUPAC Name: 2-[1-(4-tert-butyl-2-chlorophenyl)tetrazol-5-yl]sulfanyl-N-[2-chloro-4-[2-(1-hydroxycyclobutyl)ethynyl]phenyl]acetamide Traditional Name: 2-[[1-(4-tert-butyl-2-chloro-phenyl)tetrazol-5-yl]thio]-N-[2-chloro-4-[2-(1-hydroxycyclobutyl)ethynyl]phenyl]acetamide Formula: C25H25Cl2N5O2S MolecularWeight: 530.4693

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=C(C=C1)N2C(=NN=N2)SCC(=O)NC3=C(C=C(C=C3)C#CC4(CCC4)O)Cl)Cl

Isomeric SMILES

CC(C)(C)C1=CC(=C(C=C1)N2C(=NN=N2)SCC(=O)NC3=C(C=C(C=C3)C#CC4(CCC4)O)Cl)Cl

InChI

InChI=1S/C25H25Cl2N5O2S/c1-24(2,3)17-6-8-21(19(27)14-17)32-23(29-30-31-32)35-15-22(33)28-20-7-5-16(13-18(20)26)9-12-25(34)10-4-11-25/h5-8,13-14,34H,4,10-11,15H2,1-3H3,(H,28,33)