N-(2-bromanyl-4-methyl-phenyl)-2-[(4-cyclohexyl-5-methyl-1,2,4-triazol-3-yl)sulfanyl]propanamide

Systemtic Name: N-(2-bromanyl-4-methyl-phenyl)-2-[(4-cyclohexyl-5-methyl-1,2,4-triazol-3-yl)sulfanyl]propanamide Openeye Name: N-(2-bromo-4-methyl-phenyl)-2-[(4-cyclohexyl-5-methyl-1,2,4-triazol-3-yl)sulfanyl]propanamide CAS Name: N-(2-bromo-4-methylphenyl)-2-[(4-cyclohexyl-5-methyl-1,2,4-triazol-3-yl)thio]propanamide IUPAC Name: N-(2-bromo-4-methylphenyl)-2-[(4-cyclohexyl-5-methyl-1,2,4-triazol-3-yl)sulfanyl]propanamide Traditional Name: N-(2-bromo-4-methyl-phenyl)-2-[(4-cyclohexyl-5-methyl-1,2,4-triazol-3-yl)thio]propionamide Formula: C19H25BrN4OS MolecularWeight: 437.397

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)C(C)SC2=NN=C(N2C3CCCCC3)C)Br

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)C(C)SC2=NN=C(N2C3CCCCC3)C)Br

InChI

InChI=1S/C19H25BrN4OS/c1-12-9-10-17(16(20)11-12)21-18(25)13(2)26-19-23-22-14(3)24(19)15-7-5-4-6-8-15/h9-11,13,15H,4-8H2,1-3H3,(H,21,25)