[5-(4-aminocarbonyl-5-azanyl-imidazol-1-yl)-2-[[(phenylmethyl)amino]methyl]-4-propanoyloxy-oxolan-3-yl] propanoate

Systemtic Name: [5-(4-aminocarbonyl-5-azanyl-imidazol-1-yl)-2-[[(phenylmethyl)amino]methyl]-4-propanoyloxy-oxolan-3-yl] propanoate Openeye Name: [5-(5-amino-4-carbamoyl-imidazol-1-yl)-2-[(benzylamino)methyl]-4-propanoyloxy-tetrahydrofuran-3-yl] propanoate CAS Name: propanoic acid [5-(5-amino-4-carbamoyl-1-imidazolyl)-4-(1-oxopropoxy)-2-[[(phenylmethyl)amino]methyl]-3-oxolanyl] ester IUPAC Name: [5-(5-amino-4-carbamoylimidazol-1-yl)-2-[(benzylamino)methyl]-4-propanoyloxyoxolan-3-yl] propanoate Traditional Name: propionic acid [5-(5-amino-4-carbamoyl-imidazol-1-yl)-2-[(benzylamino)methyl]-4-propionyloxy-tetrahydrofuran-3-yl] ester Formula: C22H29N5O6 MolecularWeight: 459.49556

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)OC1C(OC(C1OC(=O)CC)N2C=NC(=C2N)C(=O)N)CNCC3=CC=CC=C3

Isomeric SMILES

CCC(=O)OC1C(OC(C1OC(=O)CC)N2C=NC(=C2N)C(=O)N)CNCC3=CC=CC=C3

InChI

InChI=1S/C22H29N5O6/c1-3-15(28)32-18-14(11-25-10-13-8-6-5-7-9-13)31-22(19(18)33-16(29)4-2)27-12-26-17(20(27)23)21(24)30/h5-9,12,14,18-19,22,25H,3-4,10-11,23H2,1-2H3,(H2,24,30)