5-methyl-4-(3-sulfanylpropanoyl)-1,4-thiazine-3-carboxylic acid

Systemtic Name: 5-methyl-4-(3-sulfanylpropanoyl)-1,4-thiazine-3-carboxylic acid Openeye Name: 5-methyl-4-(3-sulfanylpropanoyl)-1,4-thiazine-3-carboxylic acid CAS Name: 4-(3-mercapto-1-oxopropyl)-5-methyl-1,4-thiazine-3-carboxylic acid IUPAC Name: 5-methyl-4-(3-sulfanylpropanoyl)-1,4-thiazine-3-carboxylic acid Traditional Name: 4-(3-mercaptopropanoyl)-5-methyl-1,4-thiazine-3-carboxylic acid Formula: C9H11NO3S2 MolecularWeight: 245.31854

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC=C(N1C(=O)CCS)C(=O)O

Isomeric SMILES

CC1=CSC=C(N1C(=O)CCS)C(=O)O

InChI

InChI=1S/C9H11NO3S2/c1-6-4-15-5-7(9(12)13)10(6)8(11)2-3-14/h4-5,14H,2-3H2,1H3,(H,12,13)