4-(2-methyl-3-sulfanyl-propanoyl)-1,4-thiazine-3-carboxylic acid

Systemtic Name: 4-(2-methyl-3-sulfanyl-propanoyl)-1,4-thiazine-3-carboxylic acid Openeye Name: 4-(2-methyl-3-sulfanyl-propanoyl)-1,4-thiazine-3-carboxylic acid CAS Name: 4-(3-mercapto-2-methyl-1-oxopropyl)-1,4-thiazine-3-carboxylic acid IUPAC Name: 4-(2-methyl-3-sulfanylpropanoyl)-1,4-thiazine-3-carboxylic acid Traditional Name: 4-(3-mercapto-2-methyl-propanoyl)-1,4-thiazine-3-carboxylic acid Formula: C9H11NO3S2 MolecularWeight: 245.31854

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Descriptors Computed from Structure

Canonical SMILES:

CC(CS)C(=O)N1C=CSC=C1C(=O)O

Isomeric SMILES

CC(CS)C(=O)N1C=CSC=C1C(=O)O

InChI

InChI=1S/C9H11NO3S2/c1-6(4-14)8(11)10-2-3-15-5-7(10)9(12)13/h2-3,5-6,14H,4H2,1H3,(H,12,13)