1-[(3R,4S)-1-isoquinolin-3-yloxy-4-oxidanyl-pentan-3-yl]imidazole-4-carboxamide

Systemtic Name: 1-[(3R,4S)-1-isoquinolin-3-yloxy-4-oxidanyl-pentan-3-yl]imidazole-4-carboxamide Openeye Name: 1-[(1R,2S)-2-hydroxy-1-[2-(3-isoquinolyloxy)ethyl]propyl]imidazole-4-carboxamide CAS Name: 1-[(3R,4S)-4-hydroxy-1-(3-isoquinolinyloxy)pentan-3-yl]-4-imidazolecarboxamide IUPAC Name: 1-[(3R,4S)-4-hydroxy-1-isoquinolin-3-yloxypentan-3-yl]imidazole-4-carboxamide Traditional Name: 1-[(1R,2S)-2-hydroxy-1-[2-(3-isoquinolyloxy)ethyl]propyl]imidazole-4-carboxamide Formula: C18H20N4O3 MolecularWeight: 340.3764

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(CCOC1=CC2=CC=CC=C2C=N1)N3C=C(N=C3)C(=O)N)O

Isomeric SMILES

C[C@@H]([C@@H](CCOC1=CC2=CC=CC=C2C=N1)N3C=C(N=C3)C(=O)N)O

InChI

InChI=1S/C18H20N4O3/c1-12(23)16(22-10-15(18(19)24)21-11-22)6-7-25-17-8-13-4-2-3-5-14(13)9-20-17/h2-5,8-12,16,23H,6-7H2,1H3,(H2,19,24)/t12-,16+/m0/s1