methyl 2-[[2-butyl-3-[(2-chlorophenyl)methyl]imidazol-4-yl]-ethanoyl-amino]-3-phenyl-propanoate

Systemtic Name: methyl 2-[[2-butyl-3-[(2-chlorophenyl)methyl]imidazol-4-yl]-ethanoyl-amino]-3-phenyl-propanoate Openeye Name: methyl 2-[acetyl-[2-butyl-3-[(2-chlorophenyl)methyl]imidazol-4-yl]amino]-3-phenyl-propanoate CAS Name: 2-[acetyl-[2-butyl-3-[(2-chlorophenyl)methyl]-4-imidazolyl]amino]-3-phenylpropanoic acid methyl ester IUPAC Name: methyl 2-[acetyl-[2-butyl-3-[(2-chlorophenyl)methyl]imidazol-4-yl]amino]-3-phenylpropanoate Traditional Name: 2-[acetyl-[2-butyl-3-(2-chlorobenzyl)imidazol-4-yl]amino]-3-phenyl-propionic acid methyl ester Formula: C26H30ClN3O3 MolecularWeight: 467.9877

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC=C(N1CC2=CC=CC=C2Cl)N(C(CC3=CC=CC=C3)C(=O)OC)C(=O)C

Isomeric SMILES

CCCCC1=NC=C(N1CC2=CC=CC=C2Cl)N(C(CC3=CC=CC=C3)C(=O)OC)C(=O)C

InChI

InChI=1S/C26H30ClN3O3/c1-4-5-15-24-28-17-25(29(24)18-21-13-9-10-14-22(21)27)30(19(2)31)23(26(32)33-3)16-20-11-7-6-8-12-20/h6-14,17,23H,4-5,15-16,18H2,1-3H3