3-methyl-5-[[(2S)-2-methylpentanoyl]amino]thiophene-2-carboxylate

Systemtic Name: 3-methyl-5-[[(2S)-2-methylpentanoyl]amino]thiophene-2-carboxylate Openeye Name: 3-methyl-5-[[(2S)-2-methylpentanoyl]amino]thiophene-2-carboxylate CAS Name: 3-methyl-5-[[(2S)-2-methyl-1-oxopentyl]amino]-2-thiophenecarboxylate IUPAC Name: 3-methyl-5-[[(2S)-2-methylpentanoyl]amino]thiophene-2-carboxylate Traditional Name: 3-methyl-5-[[(2S)-2-methylpentanoyl]amino]-2-thenoate Formula: C12H16NO3S- MolecularWeight: 254.32534

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)C(=O)NC1=CC(=C(S1)C(=O)[O-])C

Isomeric SMILES

CCC[C@H](C)C(=O)NC1=CC(=C(S1)C(=O)[O-])C

InChI

InChI=1S/C12H17NO3S/c1-4-5-7(2)11(14)13-9-6-8(3)10(17-9)12(15)16/h6-7H,4-5H2,1-3H3,(H,13,14)(H,15,16)/p-1/t7-/m0/s1