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

Systemtic Name: N-(4-bromanyl-2,3-dimethyl-phenyl)-2-[(1-phenyl-1,2,3,4-tetrazol-5-yl)sulfanyl]ethanamide Openeye Name: N-(4-bromo-2,3-dimethyl-phenyl)-2-(1-phenyltetrazol-5-yl)sulfanyl-acetamide CAS Name: N-(4-bromo-2,3-dimethylphenyl)-2-[(1-phenyl-5-tetrazolyl)thio]acetamide IUPAC Name: N-(4-bromo-2,3-dimethylphenyl)-2-(1-phenyltetrazol-5-yl)sulfanylacetamide Traditional Name: N-(4-bromo-2,3-dimethyl-phenyl)-2-[(1-phenyltetrazol-5-yl)thio]acetamide Formula: C17H16BrN5OS MolecularWeight: 418.31084

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1C)Br)NC(=O)CSC2=NN=NN2C3=CC=CC=C3

Isomeric SMILES

CC1=C(C=CC(=C1C)Br)NC(=O)CSC2=NN=NN2C3=CC=CC=C3

InChI

InChI=1S/C17H16BrN5OS/c1-11-12(2)15(9-8-14(11)18)19-16(24)10-25-17-20-21-22-23(17)13-6-4-3-5-7-13/h3-9H,10H2,1-2H3,(H,19,24)