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

Systemtic Name: N-butyl-2-[[1-(2,5-dimethylphenyl)-1,2,3,4-tetrazol-5-yl]sulfanyl]-N-phenyl-ethanamide Openeye Name: N-butyl-2-[1-(2,5-dimethylphenyl)tetrazol-5-yl]sulfanyl-N-phenyl-acetamide CAS Name: N-butyl-2-[[1-(2,5-dimethylphenyl)-5-tetrazolyl]thio]-N-phenylacetamide IUPAC Name: N-butyl-2-[1-(2,5-dimethylphenyl)tetrazol-5-yl]sulfanyl-N-phenylacetamide Traditional Name: N-butyl-2-[[1-(2,5-dimethylphenyl)tetrazol-5-yl]thio]-N-phenyl-acetamide Formula: C21H25N5OS MolecularWeight: 395.5211

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C1=CC=CC=C1)C(=O)CSC2=NN=NN2C3=C(C=CC(=C3)C)C

Isomeric SMILES

CCCCN(C1=CC=CC=C1)C(=O)CSC2=NN=NN2C3=C(C=CC(=C3)C)C

InChI

InChI=1S/C21H25N5OS/c1-4-5-13-25(18-9-7-6-8-10-18)20(27)15-28-21-22-23-24-26(21)19-14-16(2)11-12-17(19)3/h6-12,14H,4-5,13,15H2,1-3H3