2-[(4-azanyl-5-cyclopropyl-1,2,4-triazol-3-yl)sulfanyl]-N-[(2S)-5-methylhexan-2-yl]ethanamide

Systemtic Name: 2-[(4-azanyl-5-cyclopropyl-1,2,4-triazol-3-yl)sulfanyl]-N-[(2S)-5-methylhexan-2-yl]ethanamide Openeye Name: 2-[(4-amino-5-cyclopropyl-1,2,4-triazol-3-yl)sulfanyl]-N-[(1S)-1,4-dimethylpentyl]acetamide CAS Name: 2-[(4-amino-5-cyclopropyl-1,2,4-triazol-3-yl)thio]-N-[(2S)-5-methylhexan-2-yl]acetamide IUPAC Name: 2-[(4-amino-5-cyclopropyl-1,2,4-triazol-3-yl)sulfanyl]-N-[(2S)-5-methylhexan-2-yl]acetamide Traditional Name: 2-[(4-amino-5-cyclopropyl-1,2,4-triazol-3-yl)thio]-N-[(1S)-1,4-dimethylpentyl]acetamide Formula: C14H25N5OS MolecularWeight: 311.4462

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCC(C)NC(=O)CSC1=NN=C(N1N)C2CC2

Isomeric SMILES

C[C@@H](CCC(C)C)NC(=O)CSC1=NN=C(N1N)C2CC2

InChI

InChI=1S/C14H25N5OS/c1-9(2)4-5-10(3)16-12(20)8-21-14-18-17-13(19(14)15)11-6-7-11/h9-11H,4-8,15H2,1-3H3,(H,16,20)/t10-/m0/s1