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

Systemtic Name: 3-[(1-tert-butyl-1,2,3,4-tetrazol-5-yl)sulfanyl]-N-(3-chloranyl-4-cyano-phenyl)propanamide Openeye Name: 3-(1-tert-butyltetrazol-5-yl)sulfanyl-N-(3-chloro-4-cyano-phenyl)propanamide CAS Name: 3-[(1-tert-butyl-5-tetrazolyl)thio]-N-(3-chloro-4-cyanophenyl)propanamide IUPAC Name: 3-(1-tert-butyltetrazol-5-yl)sulfanyl-N-(3-chloro-4-cyanophenyl)propanamide Traditional Name: 3-[(1-tert-butyltetrazol-5-yl)thio]-N-(3-chloro-4-cyano-phenyl)propionamide Formula: C15H17ClN6OS MolecularWeight: 364.85308

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)N1C(=NN=N1)SCCC(=O)NC2=CC(=C(C=C2)C#N)Cl

Isomeric SMILES

CC(C)(C)N1C(=NN=N1)SCCC(=O)NC2=CC(=C(C=C2)C#N)Cl

InChI

InChI=1S/C15H17ClN6OS/c1-15(2,3)22-14(19-20-21-22)24-7-6-13(23)18-11-5-4-10(9-17)12(16)8-11/h4-5,8H,6-7H2,1-3H3,(H,18,23)