7-[[(2-acetamido-3-methyl-butanoyl)amino]methyl]-2-azanyl-5,7-dihydro-4H-thieno[2,3-c]pyran-3-carboxylic acid

Systemtic Name: 7-[[(2-acetamido-3-methyl-butanoyl)amino]methyl]-2-azanyl-5,7-dihydro-4H-thieno[2,3-c]pyran-3-carboxylic acid Openeye Name: 7-[[(2-acetamido-3-methyl-butanoyl)amino]methyl]-2-amino-5,7-dihydro-4H-thieno[2,3-c]pyran-3-carboxylic acid CAS Name: 7-[[(2-acetamido-3-methyl-1-oxobutyl)amino]methyl]-2-amino-5,7-dihydro-4H-thieno[2,3-c]pyran-3-carboxylic acid IUPAC Name: 7-[[(2-acetamido-3-methylbutanoyl)amino]methyl]-2-amino-5,7-dihydro-4H-thieno[2,3-c]pyran-3-carboxylic acid Traditional Name: 7-[[(2-acetamido-3-methyl-butanoyl)amino]methyl]-2-amino-5,7-dihydro-4H-thieno[2,3-c]pyran-3-carboxylic acid Formula: C16H23N3O5S MolecularWeight: 369.43592

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NCC1C2=C(CCO1)C(=C(S2)N)C(=O)O)NC(=O)C

Isomeric SMILES

CC(C)C(C(=O)NCC1C2=C(CCO1)C(=C(S2)N)C(=O)O)NC(=O)C

InChI

InChI=1S/C16H23N3O5S/c1-7(2)12(19-8(3)20)15(21)18-6-10-13-9(4-5-24-10)11(16(22)23)14(17)25-13/h7,10,12H,4-6,17H2,1-3H3,(H,18,21)(H,19,20)(H,22,23)