methyl 2-[2-(1-azanyl-4-phenyl-imidazol-2-yl)sulfanylethanoylamino]ethanoate

Systemtic Name: methyl 2-[2-(1-azanyl-4-phenyl-imidazol-2-yl)sulfanylethanoylamino]ethanoate Openeye Name: methyl 2-[[2-(1-amino-4-phenyl-imidazol-2-yl)sulfanylacetyl]amino]acetate CAS Name: 2-[[2-[(1-amino-4-phenyl-2-imidazolyl)thio]-1-oxoethyl]amino]acetic acid methyl ester IUPAC Name: methyl 2-[[2-(1-amino-4-phenylimidazol-2-yl)sulfanylacetyl]amino]acetate Traditional Name: 2-[[2-[(1-amino-4-phenyl-imidazol-2-yl)thio]acetyl]amino]acetic acid methyl ester Formula: C14H16N4O3S MolecularWeight: 320.36684

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CNC(=O)CSC1=NC(=CN1N)C2=CC=CC=C2

Isomeric SMILES

COC(=O)CNC(=O)CSC1=NC(=CN1N)C2=CC=CC=C2

InChI

InChI=1S/C14H16N4O3S/c1-21-13(20)7-16-12(19)9-22-14-17-11(8-18(14)15)10-5-3-2-4-6-10/h2-6,8H,7,9,15H2,1H3,(H,16,19)