2-(3-azanyl-5-methylsulfanyl-1,2,4-triazol-4-yl)-N-(2,4,6-trimethylphenyl)butanamide

Systemtic Name: 2-(3-azanyl-5-methylsulfanyl-1,2,4-triazol-4-yl)-N-(2,4,6-trimethylphenyl)butanamide Openeye Name: 2-(3-amino-5-methylsulfanyl-1,2,4-triazol-4-yl)-N-(2,4,6-trimethylphenyl)butanamide CAS Name: 2-[3-amino-5-(methylthio)-1,2,4-triazol-4-yl]-N-(2,4,6-trimethylphenyl)butanamide IUPAC Name: 2-(3-amino-5-methylsulfanyl-1,2,4-triazol-4-yl)-N-(2,4,6-trimethylphenyl)butanamide Traditional Name: 2-[3-amino-5-(methylthio)-1,2,4-triazol-4-yl]-N-mesityl-butyramide Formula: C16H23N5OS MolecularWeight: 333.45172

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=C(C=C(C=C1C)C)C)N2C(=NN=C2SC)N

Isomeric SMILES

CCC(C(=O)NC1=C(C=C(C=C1C)C)C)N2C(=NN=C2SC)N

InChI

InChI=1S/C16H23N5OS/c1-6-12(21-15(17)19-20-16(21)23-5)14(22)18-13-10(3)7-9(2)8-11(13)4/h7-8,12H,6H2,1-5H3,(H2,17,19)(H,18,22)