methyl (2S)-3-(4-aminocarbonylphenyl)-2-[[1-cyclohexyl-2-(furan-3-yl)benzimidazol-5-yl]carbonylamino]propanoate

Systemtic Name: methyl (2S)-3-(4-aminocarbonylphenyl)-2-[[1-cyclohexyl-2-(furan-3-yl)benzimidazol-5-yl]carbonylamino]propanoate Openeye Name: methyl (2S)-3-(4-carbamoylphenyl)-2-[[1-cyclohexyl-2-(3-furyl)benzimidazole-5-carbonyl]amino]propanoate CAS Name: (2S)-3-(4-carbamoylphenyl)-2-[[[1-cyclohexyl-2-(3-furanyl)-5-benzimidazolyl]-oxomethyl]amino]propanoic acid methyl ester IUPAC Name: methyl (2S)-3-(4-carbamoylphenyl)-2-[[1-cyclohexyl-2-(furan-3-yl)benzimidazole-5-carbonyl]amino]propanoate Traditional Name: (2S)-3-(4-carbamoylphenyl)-2-[[1-cyclohexyl-2-(3-furyl)benzimidazole-5-carbonyl]amino]propionic acid methyl ester Formula: C29H30N4O5 MolecularWeight: 514.5723

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC1=CC=C(C=C1)C(=O)N)NC(=O)C2=CC3=C(C=C2)N(C(=N3)C4=COC=C4)C5CCCCC5

Isomeric SMILES

COC(=O)[C@H](CC1=CC=C(C=C1)C(=O)N)NC(=O)C2=CC3=C(C=C2)N(C(=N3)C4=COC=C4)C5CCCCC5

InChI

InChI=1S/C29H30N4O5/c1-37-29(36)24(15-18-7-9-19(10-8-18)26(30)34)32-28(35)20-11-12-25-23(16-20)31-27(21-13-14-38-17-21)33(25)22-5-3-2-4-6-22/h7-14,16-17,22,24H,2-6,15H2,1H3,(H2,30,34)(H,32,35)/t24-/m0/s1