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

Systemtic Name: 2-[[1-(4-tert-butyl-2-chloranyl-phenyl)-1,2,3,4-tetrazol-5-yl]sulfanyl]-N-(3-chloranylpyridin-4-yl)ethanamide Openeye Name: 2-[1-(4-tert-butyl-2-chloro-phenyl)tetrazol-5-yl]sulfanyl-N-(3-chloro-4-pyridyl)acetamide CAS Name: 2-[[1-(4-tert-butyl-2-chlorophenyl)-5-tetrazolyl]thio]-N-(3-chloro-4-pyridinyl)acetamide IUPAC Name: 2-[1-(4-tert-butyl-2-chlorophenyl)tetrazol-5-yl]sulfanyl-N-(3-chloropyridin-4-yl)acetamide Traditional Name: 2-[[1-(4-tert-butyl-2-chloro-phenyl)tetrazol-5-yl]thio]-N-(3-chloro-4-pyridyl)acetamide Formula: C18H18Cl2N6OS MolecularWeight: 437.34612

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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=NC=C3)Cl)Cl

Isomeric SMILES

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

InChI

InChI=1S/C18H18Cl2N6OS/c1-18(2,3)11-4-5-15(12(19)8-11)26-17(23-24-25-26)28-10-16(27)22-14-6-7-21-9-13(14)20/h4-9H,10H2,1-3H3,(H,21,22,27)