1-[(3R,4S)-1-isoquinolin-7-yloxy-4-phenylmethoxy-pentan-3-yl]imidazole-4-carboxamide

Systemtic Name: 1-[(3R,4S)-1-isoquinolin-7-yloxy-4-phenylmethoxy-pentan-3-yl]imidazole-4-carboxamide Openeye Name: 1-[(1R,2S)-2-benzyloxy-1-[2-(7-isoquinolyloxy)ethyl]propyl]imidazole-4-carboxamide CAS Name: 1-[(3R,4S)-1-(7-isoquinolinyloxy)-4-phenylmethoxypentan-3-yl]-4-imidazolecarboxamide IUPAC Name: 1-[(3R,4S)-1-isoquinolin-7-yloxy-4-phenylmethoxypentan-3-yl]imidazole-4-carboxamide Traditional Name: 1-[(1R,2S)-2-benzoxy-1-[2-(7-isoquinolyloxy)ethyl]propyl]imidazole-4-carboxamide Formula: C25H26N4O3 MolecularWeight: 430.49894

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(CCOC1=CC2=C(C=C1)C=CN=C2)N3C=C(N=C3)C(=O)N)OCC4=CC=CC=C4

Isomeric SMILES

C[C@@H]([C@@H](CCOC1=CC2=C(C=C1)C=CN=C2)N3C=C(N=C3)C(=O)N)OCC4=CC=CC=C4

InChI

InChI=1S/C25H26N4O3/c1-18(32-16-19-5-3-2-4-6-19)24(29-15-23(25(26)30)28-17-29)10-12-31-22-8-7-20-9-11-27-14-21(20)13-22/h2-9,11,13-15,17-18,24H,10,12,16H2,1H3,(H2,26,30)/t18-,24+/m0/s1