(2S)-3-azanyl-2-[2-[(4-methyl-1,3-thiazol-2-yl)sulfanyl]ethanoyl]but-3-enenitrile

Systemtic Name: (2S)-3-azanyl-2-[2-[(4-methyl-1,3-thiazol-2-yl)sulfanyl]ethanoyl]but-3-enenitrile Openeye Name: (2S)-3-amino-2-[2-(4-methylthiazol-2-yl)sulfanylacetyl]but-3-enenitrile CAS Name: (2S)-3-amino-2-[2-[(4-methyl-2-thiazolyl)thio]-1-oxoethyl]-3-butenenitrile IUPAC Name: (2S)-3-amino-2-[2-[(4-methyl-1,3-thiazol-2-yl)sulfanyl]acetyl]but-3-enenitrile Traditional Name: (2S)-3-amino-2-[2-[(4-methylthiazol-2-yl)thio]acetyl]but-3-enenitrile Formula: C10H11N3OS2 MolecularWeight: 253.34384

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC(=N1)SCC(=O)C(C#N)C(=C)N

Isomeric SMILES

CC1=CSC(=N1)SCC(=O)[C@H](C#N)C(=C)N

InChI

InChI=1S/C10H11N3OS2/c1-6-4-15-10(13-6)16-5-9(14)8(3-11)7(2)12/h4,8H,2,5,12H2,1H3/t8-/m1/s1