methyl 2-[2-(1,5-diphenylimidazol-2-yl)sulfanylethanoylamino]-3-methyl-pentanoate

Systemtic Name: methyl 2-[2-(1,5-diphenylimidazol-2-yl)sulfanylethanoylamino]-3-methyl-pentanoate Openeye Name: methyl 2-[[2-(1,5-diphenylimidazol-2-yl)sulfanylacetyl]amino]-3-methyl-pentanoate CAS Name: 2-[[2-[(1,5-diphenyl-2-imidazolyl)thio]-1-oxoethyl]amino]-3-methylpentanoic acid methyl ester IUPAC Name: methyl 2-[[2-(1,5-diphenylimidazol-2-yl)sulfanylacetyl]amino]-3-methylpentanoate Traditional Name: 2-[[2-[(1,5-diphenylimidazol-2-yl)thio]acetyl]amino]-3-methyl-valeric acid methyl ester Formula: C24H27N3O3S MolecularWeight: 437.55448

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)OC)NC(=O)CSC1=NC=C(N1C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

CCC(C)C(C(=O)OC)NC(=O)CSC1=NC=C(N1C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C24H27N3O3S/c1-4-17(2)22(23(29)30-3)26-21(28)16-31-24-25-15-20(18-11-7-5-8-12-18)27(24)19-13-9-6-10-14-19/h5-15,17,22H,4,16H2,1-3H3,(H,26,28)