methyl (2R)-2-[2-[(4-butyl-5-methyl-1H-imidazol-2-yl)sulfanyl]ethanoylamino]-2-phenyl-ethanoate

Systemtic Name: methyl (2R)-2-[2-[(4-butyl-5-methyl-1H-imidazol-2-yl)sulfanyl]ethanoylamino]-2-phenyl-ethanoate Openeye Name: methyl (2R)-2-[[2-[(4-butyl-5-methyl-1H-imidazol-2-yl)sulfanyl]acetyl]amino]-2-phenyl-acetate CAS Name: (2R)-2-[[2-[(4-butyl-5-methyl-1H-imidazol-2-yl)thio]-1-oxoethyl]amino]-2-phenylacetic acid methyl ester IUPAC Name: methyl (2R)-2-[[2-[(4-butyl-5-methyl-1H-imidazol-2-yl)sulfanyl]acetyl]amino]-2-phenylacetate Traditional Name: (2R)-2-[[2-[(4-butyl-5-methyl-1H-imidazol-2-yl)thio]acetyl]amino]-2-phenyl-acetic acid methyl ester Formula: C19H25N3O3S MolecularWeight: 375.4851

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(NC(=N1)SCC(=O)NC(C2=CC=CC=C2)C(=O)OC)C

Isomeric SMILES

CCCCC1=C(NC(=N1)SCC(=O)N[C@H](C2=CC=CC=C2)C(=O)OC)C

InChI

InChI=1S/C19H25N3O3S/c1-4-5-11-15-13(2)20-19(21-15)26-12-16(23)22-17(18(24)25-3)14-9-7-6-8-10-14/h6-10,17H,4-5,11-12H2,1-3H3,(H,20,21)(H,22,23)/t17-/m1/s1