4-[[1-(2,3-dimethylphenyl)-1,2,3,4-tetrazol-5-yl]sulfanylmethyl]-N-phenyl-benzamide

Systemtic Name: 4-[[1-(2,3-dimethylphenyl)-1,2,3,4-tetrazol-5-yl]sulfanylmethyl]-N-phenyl-benzamide Openeye Name: 4-[[1-(2,3-dimethylphenyl)tetrazol-5-yl]sulfanylmethyl]-N-phenyl-benzamide CAS Name: 4-[[[1-(2,3-dimethylphenyl)-5-tetrazolyl]thio]methyl]-N-phenylbenzamide IUPAC Name: 4-[[1-(2,3-dimethylphenyl)tetrazol-5-yl]sulfanylmethyl]-N-phenylbenzamide Traditional Name: 4-[[[1-(2,3-dimethylphenyl)tetrazol-5-yl]thio]methyl]-N-phenyl-benzamide Formula: C23H21N5OS MolecularWeight: 415.51074

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)N2C(=NN=N2)SCC3=CC=C(C=C3)C(=O)NC4=CC=CC=C4)C

Isomeric SMILES

CC1=C(C(=CC=C1)N2C(=NN=N2)SCC3=CC=C(C=C3)C(=O)NC4=CC=CC=C4)C

InChI

InChI=1S/C23H21N5OS/c1-16-7-6-10-21(17(16)2)28-23(25-26-27-28)30-15-18-11-13-19(14-12-18)22(29)24-20-8-4-3-5-9-20/h3-14H,15H2,1-2H3,(H,24,29)