2-acetamido-N-[5-(2-azanyl-2-oxidanylidene-ethyl)sulfanyl-4-methyl-1,3-thiazol-2-yl]-3-methyl-butanamide

Systemtic Name: 2-acetamido-N-[5-(2-azanyl-2-oxidanylidene-ethyl)sulfanyl-4-methyl-1,3-thiazol-2-yl]-3-methyl-butanamide Openeye Name: 2-acetamido-N-[5-(2-amino-2-oxo-ethyl)sulfanyl-4-methyl-thiazol-2-yl]-3-methyl-butanamide CAS Name: 2-acetamido-N-[5-[(2-amino-2-oxoethyl)thio]-4-methyl-2-thiazolyl]-3-methylbutanamide IUPAC Name: 2-acetamido-N-[5-(2-amino-2-oxoethyl)sulfanyl-4-methyl-1,3-thiazol-2-yl]-3-methylbutanamide Traditional Name: 2-acetamido-N-[5-[(2-amino-2-keto-ethyl)thio]-4-methyl-thiazol-2-yl]-3-methyl-butyramide Formula: C13H20N4O3S2 MolecularWeight: 344.4529

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)NC(=O)C(C(C)C)NC(=O)C)SCC(=O)N

Isomeric SMILES

CC1=C(SC(=N1)NC(=O)C(C(C)C)NC(=O)C)SCC(=O)N

InChI

InChI=1S/C13H20N4O3S2/c1-6(2)10(16-8(4)18)11(20)17-13-15-7(3)12(22-13)21-5-9(14)19/h6,10H,5H2,1-4H3,(H2,14,19)(H,16,18)(H,15,17,20)