(4S)-4-[[(2S)-2-azanyl-3-phenyl-propanoyl]amino]-5-sulfanyl-pentanamide

Systemtic Name: (4S)-4-[[(2S)-2-azanyl-3-phenyl-propanoyl]amino]-5-sulfanyl-pentanamide Openeye Name: (4S)-4-[[(2S)-2-amino-3-phenyl-propanoyl]amino]-5-sulfanyl-pentanamide CAS Name: (4S)-4-[[(2S)-2-amino-1-oxo-3-phenylpropyl]amino]-5-mercaptopentanamide IUPAC Name: (4S)-4-[[(2S)-2-amino-3-phenylpropanoyl]amino]-5-sulfanylpentanamide Traditional Name: (4S)-4-[[(2S)-2-amino-3-phenyl-propanoyl]amino]-5-mercapto-valeramide Formula: C14H21N3O2S MolecularWeight: 295.40044

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(=O)NC(CCC(=O)N)CS)N

Isomeric SMILES

C1=CC=C(C=C1)C[C@@H](C(=O)N[C@@H](CCC(=O)N)CS)N

InChI

InChI=1S/C14H21N3O2S/c15-12(8-10-4-2-1-3-5-10)14(19)17-11(9-20)6-7-13(16)18/h1-5,11-12,20H,6-9,15H2,(H2,16,18)(H,17,19)/t11-,12-/m0/s1