2-[(2-azanyl-1,3-thiazol-5-yl)methyl]-5-phenyl-3-sulfanyl-pentanoic acid

Systemtic Name: 2-[(2-azanyl-1,3-thiazol-5-yl)methyl]-5-phenyl-3-sulfanyl-pentanoic acid Openeye Name: 2-[(2-aminothiazol-5-yl)methyl]-5-phenyl-3-sulfanyl-pentanoic acid CAS Name: 2-[(2-amino-5-thiazolyl)methyl]-3-mercapto-5-phenylpentanoic acid IUPAC Name: 2-[(2-amino-1,3-thiazol-5-yl)methyl]-5-phenyl-3-sulfanylpentanoic acid Traditional Name: 2-[(2-aminothiazol-5-yl)methyl]-3-mercapto-5-phenyl-valeric acid Formula: C15H18N2O2S2 MolecularWeight: 322.44562

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCC(C(CC2=CN=C(S2)N)C(=O)O)S

Isomeric SMILES

C1=CC=C(C=C1)CCC(C(CC2=CN=C(S2)N)C(=O)O)S

InChI

InChI=1S/C15H18N2O2S2/c16-15-17-9-11(21-15)8-12(14(18)19)13(20)7-6-10-4-2-1-3-5-10/h1-5,9,12-13,20H,6-8H2,(H2,16,17)(H,18,19)