methyl 3-(5-azanyl-1H-indol-3-yl)-2-[[1-cyclohexyl-2-(furan-3-yl)benzimidazol-5-yl]carbonylamino]propanoate

Systemtic Name: methyl 3-(5-azanyl-1H-indol-3-yl)-2-[[1-cyclohexyl-2-(furan-3-yl)benzimidazol-5-yl]carbonylamino]propanoate Openeye Name: methyl 3-(5-amino-1H-indol-3-yl)-2-[[1-cyclohexyl-2-(3-furyl)benzimidazole-5-carbonyl]amino]propanoate CAS Name: 3-(5-amino-1H-indol-3-yl)-2-[[[1-cyclohexyl-2-(3-furanyl)-5-benzimidazolyl]-oxomethyl]amino]propanoic acid methyl ester IUPAC Name: methyl 3-(5-amino-1H-indol-3-yl)-2-[[1-cyclohexyl-2-(furan-3-yl)benzimidazole-5-carbonyl]amino]propanoate Traditional Name: 3-(5-amino-1H-indol-3-yl)-2-[[1-cyclohexyl-2-(3-furyl)benzimidazole-5-carbonyl]amino]propionic acid methyl ester Formula: C30H31N5O4 MolecularWeight: 525.59824

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC1=CNC2=C1C=C(C=C2)N)NC(=O)C3=CC4=C(C=C3)N(C(=N4)C5=COC=C5)C6CCCCC6

Isomeric SMILES

COC(=O)C(CC1=CNC2=C1C=C(C=C2)N)NC(=O)C3=CC4=C(C=C3)N(C(=N4)C5=COC=C5)C6CCCCC6

InChI

InChI=1S/C30H31N5O4/c1-38-30(37)26(14-20-16-32-24-9-8-21(31)15-23(20)24)34-29(36)18-7-10-27-25(13-18)33-28(19-11-12-39-17-19)35(27)22-5-3-2-4-6-22/h7-13,15-17,22,26,32H,2-6,14,31H2,1H3,(H,34,36)