[(2S)-3-methyl-2-[[(1S)-1-pyridin-2-ylbut-3-enyl]amino]butyl] imidazole-1-carboxylate

Systemtic Name: [(2S)-3-methyl-2-[[(1S)-1-pyridin-2-ylbut-3-enyl]amino]butyl] imidazole-1-carboxylate Openeye Name: [(2S)-3-methyl-2-[[(1S)-1-(2-pyridyl)but-3-enyl]amino]butyl] imidazole-1-carboxylate CAS Name: 1-imidazolecarboxylic acid [(2S)-3-methyl-2-[[(1S)-1-(2-pyridinyl)but-3-enyl]amino]butyl] ester IUPAC Name: [(2S)-3-methyl-2-[[(1S)-1-pyridin-2-ylbut-3-enyl]amino]butyl] imidazole-1-carboxylate Traditional Name: imidazole-1-carboxylic acid [(2S)-3-methyl-2-[[(1S)-1-(2-pyridyl)but-3-enyl]amino]butyl] ester Formula: C18H24N4O2 MolecularWeight: 328.40876

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(COC(=O)N1C=CN=C1)NC(CC=C)C2=CC=CC=N2

Isomeric SMILES

CC(C)[C@@H](COC(=O)N1C=CN=C1)N[C@@H](CC=C)C2=CC=CC=N2

InChI

InChI=1S/C18H24N4O2/c1-4-7-16(15-8-5-6-9-20-15)21-17(14(2)3)12-24-18(23)22-11-10-19-13-22/h4-6,8-11,13-14,16-17,21H,1,7,12H2,2-3H3/t16-,17+/m0/s1