2-[(4-azanyl-5-propyl-1,2,4-triazol-3-yl)sulfanyl]-N-(2,4-dimethylphenyl)propanamide

Systemtic Name: 2-[(4-azanyl-5-propyl-1,2,4-triazol-3-yl)sulfanyl]-N-(2,4-dimethylphenyl)propanamide Openeye Name: 2-[(4-amino-5-propyl-1,2,4-triazol-3-yl)sulfanyl]-N-(2,4-dimethylphenyl)propanamide CAS Name: 2-[(4-amino-5-propyl-1,2,4-triazol-3-yl)thio]-N-(2,4-dimethylphenyl)propanamide IUPAC Name: 2-[(4-amino-5-propyl-1,2,4-triazol-3-yl)sulfanyl]-N-(2,4-dimethylphenyl)propanamide Traditional Name: 2-[(4-amino-5-propyl-1,2,4-triazol-3-yl)thio]-N-(2,4-dimethylphenyl)propionamide Formula: C16H23N5OS MolecularWeight: 333.45172

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NN=C(N1N)SC(C)C(=O)NC2=C(C=C(C=C2)C)C

Isomeric SMILES

CCCC1=NN=C(N1N)SC(C)C(=O)NC2=C(C=C(C=C2)C)C

InChI

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