tert-butyl 2-azanyl-4-[3-[[(E)-3-phenylprop-2-enoyl]amino]propyl]imidazole-1-carboxylate

Systemtic Name: tert-butyl 2-azanyl-4-[3-[[(E)-3-phenylprop-2-enoyl]amino]propyl]imidazole-1-carboxylate Openeye Name: tert-butyl 2-amino-4-[3-[[(E)-3-phenylprop-2-enoyl]amino]propyl]imidazole-1-carboxylate CAS Name: 2-amino-4-[3-[[(E)-1-oxo-3-phenylprop-2-enyl]amino]propyl]-1-imidazolecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 2-amino-4-[3-[[(E)-3-phenylprop-2-enoyl]amino]propyl]imidazole-1-carboxylate Traditional Name: 2-amino-4-[3-[[(E)-3-phenylacryloyl]amino]propyl]imidazole-1-carboxylic acid tert-butyl ester Formula: C20H26N4O3 MolecularWeight: 370.44544

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1C=C(N=C1N)CCCNC(=O)C=CC2=CC=CC=C2

Isomeric SMILES

CC(C)(C)OC(=O)N1C=C(N=C1N)CCCNC(=O)/C=C/C2=CC=CC=C2

InChI

InChI=1S/C20H26N4O3/c1-20(2,3)27-19(26)24-14-16(23-18(24)21)10-7-13-22-17(25)12-11-15-8-5-4-6-9-15/h4-6,8-9,11-12,14H,7,10,13H2,1-3H3,(H2,21,23)(H,22,25)/b12-11+