2-[1-(1-azanyl-1-oxidanylidene-propan-2-yl)-5-phenyl-imidazol-2-yl]sulfanylethanoic acid

Systemtic Name: 2-[1-(1-azanyl-1-oxidanylidene-propan-2-yl)-5-phenyl-imidazol-2-yl]sulfanylethanoic acid Openeye Name: 2-[1-(2-amino-1-methyl-2-oxo-ethyl)-5-phenyl-imidazol-2-yl]sulfanylacetic acid CAS Name: 2-[[1-(1-amino-1-oxopropan-2-yl)-5-phenyl-2-imidazolyl]thio]acetic acid IUPAC Name: 2-[1-(1-amino-1-oxopropan-2-yl)-5-phenylimidazol-2-yl]sulfanylacetic acid Traditional Name: 2-[[1-(2-amino-2-keto-1-methyl-ethyl)-5-phenyl-imidazol-2-yl]thio]acetic acid Formula: C14H15N3O3S MolecularWeight: 305.3522

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N)N1C(=CN=C1SCC(=O)O)C2=CC=CC=C2

Isomeric SMILES

CC(C(=O)N)N1C(=CN=C1SCC(=O)O)C2=CC=CC=C2

InChI

InChI=1S/C14H15N3O3S/c1-9(13(15)20)17-11(10-5-3-2-4-6-10)7-16-14(17)21-8-12(18)19/h2-7,9H,8H2,1H3,(H2,15,20)(H,18,19)