N-(4-bromanyl-2-chloranyl-phenyl)-2-[(4,5-dicyclopropyl-1,2,4-triazol-3-yl)sulfanyl]ethanamide

Systemtic Name: N-(4-bromanyl-2-chloranyl-phenyl)-2-[(4,5-dicyclopropyl-1,2,4-triazol-3-yl)sulfanyl]ethanamide Openeye Name: N-(4-bromo-2-chloro-phenyl)-2-[(4,5-dicyclopropyl-1,2,4-triazol-3-yl)sulfanyl]acetamide CAS Name: N-(4-bromo-2-chlorophenyl)-2-[(4,5-dicyclopropyl-1,2,4-triazol-3-yl)thio]acetamide IUPAC Name: N-(4-bromo-2-chlorophenyl)-2-[(4,5-dicyclopropyl-1,2,4-triazol-3-yl)sulfanyl]acetamide Traditional Name: N-(4-bromo-2-chloro-phenyl)-2-[(4,5-dicyclopropyl-1,2,4-triazol-3-yl)thio]acetamide Formula: C16H16BrClN4OS MolecularWeight: 427.74644

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C2=NN=C(N2C3CC3)SCC(=O)NC4=C(C=C(C=C4)Br)Cl

Isomeric SMILES

C1CC1C2=NN=C(N2C3CC3)SCC(=O)NC4=C(C=C(C=C4)Br)Cl

InChI

InChI=1S/C16H16BrClN4OS/c17-10-3-6-13(12(18)7-10)19-14(23)8-24-16-21-20-15(9-1-2-9)22(16)11-4-5-11/h3,6-7,9,11H,1-2,4-5,8H2,(H,19,23)