2-(1-butyl-4,5-dimethyl-imidazol-2-yl)sulfanylpropanamide

Systemtic Name: 2-(1-butyl-4,5-dimethyl-imidazol-2-yl)sulfanylpropanamide Openeye Name: 2-(1-butyl-4,5-dimethyl-imidazol-2-yl)sulfanylpropanamide CAS Name: 2-[(1-butyl-4,5-dimethyl-2-imidazolyl)thio]propanamide IUPAC Name: 2-(1-butyl-4,5-dimethylimidazol-2-yl)sulfanylpropanamide Traditional Name: 2-[(1-butyl-4,5-dimethyl-imidazol-2-yl)thio]propionamide Formula: C12H21N3OS MolecularWeight: 255.37964

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(N=C1SC(C)C(=O)N)C)C

Isomeric SMILES

CCCCN1C(=C(N=C1SC(C)C(=O)N)C)C

InChI

InChI=1S/C12H21N3OS/c1-5-6-7-15-9(3)8(2)14-12(15)17-10(4)11(13)16/h10H,5-7H2,1-4H3,(H2,13,16)