3-oxidanylidene-3-(1-propan-2-ylimidazol-4-yl)propanethioamide hydrochloride

Systemtic Name: 3-oxidanylidene-3-(1-propan-2-ylimidazol-4-yl)propanethioamide hydrochloride Openeye Name: 3-(1-isopropylimidazol-4-yl)-3-oxo-propanethioamide hydrochloride CAS Name: 3-oxo-3-(1-propan-2-yl-4-imidazolyl)propanethioamide hydrochloride IUPAC Name: 3-oxo-3-(1-propan-2-ylimidazol-4-yl)propanethioamide hydrochloride Traditional Name: 3-(1-isopropylimidazol-4-yl)-3-keto-thiopropionamide hydrochloride Formula: C9H14ClN3OS MolecularWeight: 247.74496

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C=C(N=C1)C(=O)CC(=S)N.Cl

Isomeric SMILES

CC(C)N1C=C(N=C1)C(=O)CC(=S)N.Cl

InChI

InChI=1S/C9H13N3OS.ClH/c1-6(2)12-4-7(11-5-12)8(13)3-9(10)14;/h4-6H,3H2,1-2H3,(H2,10,14);1H