ethyl 4-[2-[[4,5-bis(4-methylphenyl)-1H-imidazol-2-yl]sulfanyl]ethanoylamino]butanoate

Systemtic Name: ethyl 4-[2-[[4,5-bis(4-methylphenyl)-1H-imidazol-2-yl]sulfanyl]ethanoylamino]butanoate Openeye Name: ethyl 4-[[2-[[4,5-bis(p-tolyl)-1H-imidazol-2-yl]sulfanyl]acetyl]amino]butanoate CAS Name: 4-[[2-[[4,5-bis(4-methylphenyl)-1H-imidazol-2-yl]thio]-1-oxoethyl]amino]butanoic acid ethyl ester IUPAC Name: ethyl 4-[[2-[[4,5-bis(4-methylphenyl)-1H-imidazol-2-yl]sulfanyl]acetyl]amino]butanoate Traditional Name: 4-[[2-[[4,5-bis(p-tolyl)-1H-imidazol-2-yl]thio]acetyl]amino]butyric acid ethyl ester Formula: C25H29N3O3S MolecularWeight: 451.58106

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCCNC(=O)CSC1=NC(=C(N1)C2=CC=C(C=C2)C)C3=CC=C(C=C3)C

Isomeric SMILES

CCOC(=O)CCCNC(=O)CSC1=NC(=C(N1)C2=CC=C(C=C2)C)C3=CC=C(C=C3)C

InChI

InChI=1S/C25H29N3O3S/c1-4-31-22(30)6-5-15-26-21(29)16-32-25-27-23(19-11-7-17(2)8-12-19)24(28-25)20-13-9-18(3)10-14-20/h7-14H,4-6,15-16H2,1-3H3,(H,26,29)(H,27,28)