2-azanyl-3-(methylsulfanylmethyl)-4-oxidanylidene-2-(2-phenylphenyl)carbonyl-4-(pyridin-2-ylamino)butanoic acid

Systemtic Name: 2-azanyl-3-(methylsulfanylmethyl)-4-oxidanylidene-2-(2-phenylphenyl)carbonyl-4-(pyridin-2-ylamino)butanoic acid Openeye Name: 2-amino-3-(methylsulfanylmethyl)-4-oxo-2-(2-phenylbenzoyl)-4-(2-pyridylamino)butanoic acid CAS Name: 2-amino-3-[(methylthio)methyl]-4-oxo-2-[oxo-(2-phenylphenyl)methyl]-4-(2-pyridinylamino)butanoic acid IUPAC Name: 2-amino-3-(methylsulfanylmethyl)-4-oxo-2-(2-phenylbenzoyl)-4-(pyridin-2-ylamino)butanoic acid Traditional Name: 2-amino-4-keto-3-[(methylthio)methyl]-2-(2-phenylbenzoyl)-4-(2-pyridylamino)butyric acid Formula: C24H23N3O4S MolecularWeight: 449.52212

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Descriptors Computed from Structure

Canonical SMILES:

CSCC(C(=O)NC1=CC=CC=N1)C(C(=O)C2=CC=CC=C2C3=CC=CC=C3)(C(=O)O)N

Isomeric SMILES

CSCC(C(=O)NC1=CC=CC=N1)C(C(=O)C2=CC=CC=C2C3=CC=CC=C3)(C(=O)O)N

InChI

InChI=1S/C24H23N3O4S/c1-32-15-19(22(29)27-20-13-7-8-14-26-20)24(25,23(30)31)21(28)18-12-6-5-11-17(18)16-9-3-2-4-10-16/h2-14,19H,15,25H2,1H3,(H,30,31)(H,26,27,29)