(2S)-2-[[(2R)-2-acetamido-3-sulfanyl-propanoyl]amino]-3-thiophen-2-yl-propanamide

Systemtic Name: (2S)-2-[[(2R)-2-acetamido-3-sulfanyl-propanoyl]amino]-3-thiophen-2-yl-propanamide Openeye Name: (2S)-2-[[(2R)-2-acetamido-3-sulfanyl-propanoyl]amino]-3-(2-thienyl)propanamide CAS Name: (2S)-2-[[(2R)-2-acetamido-3-mercapto-1-oxopropyl]amino]-3-thiophen-2-ylpropanamide IUPAC Name: (2S)-2-[[(2R)-2-acetamido-3-sulfanylpropanoyl]amino]-3-thiophen-2-ylpropanamide Traditional Name: (2S)-2-[[(2R)-2-acetamido-3-mercapto-propanoyl]amino]-3-(2-thienyl)propionamide Formula: C12H17N3O3S2 MolecularWeight: 315.41168

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(CS)C(=O)NC(CC1=CC=CS1)C(=O)N

Isomeric SMILES

CC(=O)N[C@@H](CS)C(=O)N[C@@H](CC1=CC=CS1)C(=O)N

InChI

InChI=1S/C12H17N3O3S2/c1-7(16)14-10(6-19)12(18)15-9(11(13)17)5-8-3-2-4-20-8/h2-4,9-10,19H,5-6H2,1H3,(H2,13,17)(H,14,16)(H,15,18)/t9-,10-/m0/s1