S-[2-acetamido-3-(4-azanyl-5-oxidanylidene-thiolan-3-yl)-3-oxidanylidene-propyl] thiophene-2-carbothioate

Systemtic Name: S-[2-acetamido-3-(4-azanyl-5-oxidanylidene-thiolan-3-yl)-3-oxidanylidene-propyl] thiophene-2-carbothioate Openeye Name: S-[2-acetamido-3-(4-amino-5-oxo-tetrahydrothiophen-3-yl)-3-oxo-propyl] thiophene-2-carbothioate CAS Name: 2-thiophenecarbothioic acid S-[2-acetamido-3-(4-amino-5-oxo-3-thiolanyl)-3-oxopropyl] ester IUPAC Name: S-[2-acetamido-3-(4-amino-5-oxothiolan-3-yl)-3-oxopropyl] thiophene-2-carbothioate Traditional Name: thiophene-2-carbothioic acid S-[2-acetamido-3-(4-amino-5-keto-tetrahydrothiophen-3-yl)-3-keto-propyl] ester Formula: C14H16N2O4S3 MolecularWeight: 372.48284

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(CSC(=O)C1=CC=CS1)C(=O)C2CSC(=O)C2N

Isomeric SMILES

CC(=O)NC(CSC(=O)C1=CC=CS1)C(=O)C2CSC(=O)C2N

InChI

InChI=1S/C14H16N2O4S3/c1-7(17)16-9(6-23-13(19)10-3-2-4-21-10)12(18)8-5-22-14(20)11(8)15/h2-4,8-9,11H,5-6,15H2,1H3,(H,16,17)