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

Systemtic Name: N-(2-bromanyl-4-methyl-phenyl)-2-[(4-cyclopropyl-1,2,4-triazol-3-yl)sulfanyl]propanamide Openeye Name: N-(2-bromo-4-methyl-phenyl)-2-[(4-cyclopropyl-1,2,4-triazol-3-yl)sulfanyl]propanamide CAS Name: N-(2-bromo-4-methylphenyl)-2-[(4-cyclopropyl-1,2,4-triazol-3-yl)thio]propanamide IUPAC Name: N-(2-bromo-4-methylphenyl)-2-[(4-cyclopropyl-1,2,4-triazol-3-yl)sulfanyl]propanamide Traditional Name: N-(2-bromo-4-methyl-phenyl)-2-[(4-cyclopropyl-1,2,4-triazol-3-yl)thio]propionamide Formula: C15H17BrN4OS MolecularWeight: 381.29068

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)C(C)SC2=NN=CN2C3CC3)Br

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)C(C)SC2=NN=CN2C3CC3)Br

InChI

InChI=1S/C15H17BrN4OS/c1-9-3-6-13(12(16)7-9)18-14(21)10(2)22-15-19-17-8-20(15)11-4-5-11/h3,6-8,10-11H,4-5H2,1-2H3,(H,18,21)