2-[[1-(3-chlorophenyl)-1,2,3,4-tetrazol-5-yl]sulfanyl]-N-[(1R)-1-phenylbutyl]ethanamide

Systemtic Name: 2-[[1-(3-chlorophenyl)-1,2,3,4-tetrazol-5-yl]sulfanyl]-N-[(1R)-1-phenylbutyl]ethanamide Openeye Name: 2-[1-(3-chlorophenyl)tetrazol-5-yl]sulfanyl-N-[(1R)-1-phenylbutyl]acetamide CAS Name: 2-[[1-(3-chlorophenyl)-5-tetrazolyl]thio]-N-[(1R)-1-phenylbutyl]acetamide IUPAC Name: 2-[1-(3-chlorophenyl)tetrazol-5-yl]sulfanyl-N-[(1R)-1-phenylbutyl]acetamide Traditional Name: 2-[[1-(3-chlorophenyl)tetrazol-5-yl]thio]-N-[(1R)-1-phenylbutyl]acetamide Formula: C19H20ClN5OS MolecularWeight: 401.913

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C1=CC=CC=C1)NC(=O)CSC2=NN=NN2C3=CC(=CC=C3)Cl

Isomeric SMILES

CCC[C@H](C1=CC=CC=C1)NC(=O)CSC2=NN=NN2C3=CC(=CC=C3)Cl

InChI

InChI=1S/C19H20ClN5OS/c1-2-7-17(14-8-4-3-5-9-14)21-18(26)13-27-19-22-23-24-25(19)16-11-6-10-15(20)12-16/h3-6,8-12,17H,2,7,13H2,1H3,(H,21,26)/t17-/m1/s1