1-[(3R,4S)-4-oxidanyl-1-quinolin-2-ylsulfanyl-pentan-3-yl]imidazole-4-carboxamide

Systemtic Name: 1-[(3R,4S)-4-oxidanyl-1-quinolin-2-ylsulfanyl-pentan-3-yl]imidazole-4-carboxamide Openeye Name: 1-[(1R,2S)-2-hydroxy-1-[2-(2-quinolylsulfanyl)ethyl]propyl]imidazole-4-carboxamide CAS Name: 1-[(3R,4S)-4-hydroxy-1-(2-quinolinylthio)pentan-3-yl]-4-imidazolecarboxamide IUPAC Name: 1-[(3R,4S)-4-hydroxy-1-quinolin-2-ylsulfanylpentan-3-yl]imidazole-4-carboxamide Traditional Name: 1-[(1R,2S)-2-hydroxy-1-[2-(2-quinolylthio)ethyl]propyl]imidazole-4-carboxamide Formula: C18H20N4O2S MolecularWeight: 356.442

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(CCSC1=NC2=CC=CC=C2C=C1)N3C=C(N=C3)C(=O)N)O

Isomeric SMILES

C[C@@H]([C@@H](CCSC1=NC2=CC=CC=C2C=C1)N3C=C(N=C3)C(=O)N)O

InChI

InChI=1S/C18H20N4O2S/c1-12(23)16(22-10-15(18(19)24)20-11-22)8-9-25-17-7-6-13-4-2-3-5-14(13)21-17/h2-7,10-12,16,23H,8-9H2,1H3,(H2,19,24)/t12-,16+/m0/s1