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

Systemtic Name: 2-(3-azanyl-5-ethylsulfanyl-1,2,4-triazol-4-yl)-N-(2,4,6-trimethylphenyl)butanamide Openeye Name: 2-(3-amino-5-ethylsulfanyl-1,2,4-triazol-4-yl)-N-(2,4,6-trimethylphenyl)butanamide CAS Name: 2-[3-amino-5-(ethylthio)-1,2,4-triazol-4-yl]-N-(2,4,6-trimethylphenyl)butanamide IUPAC Name: 2-(3-amino-5-ethylsulfanyl-1,2,4-triazol-4-yl)-N-(2,4,6-trimethylphenyl)butanamide Traditional Name: 2-[3-amino-5-(ethylthio)-1,2,4-triazol-4-yl]-N-mesityl-butyramide Formula: C17H25N5OS MolecularWeight: 347.4783

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=C(C=C(C=C1C)C)C)N2C(=NN=C2SCC)N

Isomeric SMILES

CCC(C(=O)NC1=C(C=C(C=C1C)C)C)N2C(=NN=C2SCC)N

InChI

InChI=1S/C17H25N5OS/c1-6-13(22-16(18)20-21-17(22)24-7-2)15(23)19-14-11(4)8-10(3)9-12(14)5/h8-9,13H,6-7H2,1-5H3,(H2,18,20)(H,19,23)