2-[[(2S)-2-(naphthalen-2-ylcarbonylamino)-3-phenyl-propanoyl]amino]-4-sulfanyl-butanoic acid

Systemtic Name: 2-[[(2S)-2-(naphthalen-2-ylcarbonylamino)-3-phenyl-propanoyl]amino]-4-sulfanyl-butanoic acid Openeye Name: 2-[[(2S)-2-(naphthalene-2-carbonylamino)-3-phenyl-propanoyl]amino]-4-sulfanyl-butanoic acid CAS Name: 4-mercapto-2-[[(2S)-2-[[2-naphthalenyl(oxo)methyl]amino]-1-oxo-3-phenylpropyl]amino]butanoic acid IUPAC Name: 2-[[(2S)-2-(naphthalene-2-carbonylamino)-3-phenylpropanoyl]amino]-4-sulfanylbutanoic acid Traditional Name: 4-mercapto-2-[[(2S)-2-(2-naphthoylamino)-3-phenyl-propanoyl]amino]butyric acid Formula: C24H24N2O4S MolecularWeight: 436.52336

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(=O)NC(CCS)C(=O)O)NC(=O)C2=CC3=CC=CC=C3C=C2

Isomeric SMILES

C1=CC=C(C=C1)C[C@@H](C(=O)NC(CCS)C(=O)O)NC(=O)C2=CC3=CC=CC=C3C=C2

InChI

InChI=1S/C24H24N2O4S/c27-22(19-11-10-17-8-4-5-9-18(17)15-19)26-21(14-16-6-2-1-3-7-16)23(28)25-20(12-13-31)24(29)30/h1-11,15,20-21,31H,12-14H2,(H,25,28)(H,26,27)(H,29,30)/t20?,21-/m0/s1