(2R)-2-[(4-butyl-5-oxidanylidene-1H-1,2,4-triazol-3-yl)sulfanyl]-N-methyl-propanamide

Systemtic Name: (2R)-2-[(4-butyl-5-oxidanylidene-1H-1,2,4-triazol-3-yl)sulfanyl]-N-methyl-propanamide Openeye Name: (2R)-2-[(4-butyl-5-oxo-1H-1,2,4-triazol-3-yl)sulfanyl]-N-methyl-propanamide CAS Name: (2R)-2-[(4-butyl-5-oxo-1H-1,2,4-triazol-3-yl)thio]-N-methylpropanamide IUPAC Name: (2R)-2-[(4-butyl-5-oxo-1H-1,2,4-triazol-3-yl)sulfanyl]-N-methylpropanamide Traditional Name: (2R)-2-[(4-butyl-5-keto-1H-1,2,4-triazol-3-yl)thio]-N-methyl-propionamide Formula: C10H18N4O2S MolecularWeight: 258.34052

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)NN=C1SC(C)C(=O)NC

Isomeric SMILES

CCCCN1C(=O)NN=C1S[C@H](C)C(=O)NC

InChI

InChI=1S/C10H18N4O2S/c1-4-5-6-14-9(16)12-13-10(14)17-7(2)8(15)11-3/h7H,4-6H2,1-3H3,(H,11,15)(H,12,16)/t7-/m1/s1