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

Systemtic Name: (phenylmethyl) 2-[2-[[5-methyl-4-(phenylmethyl)-1H-imidazol-2-yl]sulfanyl]ethanoylamino]ethanoate Openeye Name: benzyl 2-[[2-[(4-benzyl-5-methyl-1H-imidazol-2-yl)sulfanyl]acetyl]amino]acetate CAS Name: 2-[[2-[[5-methyl-4-(phenylmethyl)-1H-imidazol-2-yl]thio]-1-oxoethyl]amino]acetic acid (phenylmethyl) ester IUPAC Name: benzyl 2-[[2-[(4-benzyl-5-methyl-1H-imidazol-2-yl)sulfanyl]acetyl]amino]acetate Traditional Name: 2-[[2-[(4-benzyl-5-methyl-1H-imidazol-2-yl)thio]acetyl]amino]acetic acid benzyl ester Formula: C22H23N3O3S MolecularWeight: 409.50132

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(N1)SCC(=O)NCC(=O)OCC2=CC=CC=C2)CC3=CC=CC=C3

Isomeric SMILES

CC1=C(N=C(N1)SCC(=O)NCC(=O)OCC2=CC=CC=C2)CC3=CC=CC=C3

InChI

InChI=1S/C22H23N3O3S/c1-16-19(12-17-8-4-2-5-9-17)25-22(24-16)29-15-20(26)23-13-21(27)28-14-18-10-6-3-7-11-18/h2-11H,12-15H2,1H3,(H,23,26)(H,24,25)