1-[5-phenylsulfanyl-4-propan-2-yl-1-(pyridin-4-ylmethyl)imidazol-2-yl]ethyl ethanoate

Systemtic Name: 1-[5-phenylsulfanyl-4-propan-2-yl-1-(pyridin-4-ylmethyl)imidazol-2-yl]ethyl ethanoate Openeye Name: 1-[4-isopropyl-5-phenylsulfanyl-1-(4-pyridylmethyl)imidazol-2-yl]ethyl acetate CAS Name: acetic acid 1-[5-(phenylthio)-4-propan-2-yl-1-(pyridin-4-ylmethyl)-2-imidazolyl]ethyl ester IUPAC Name: 1-[5-phenylsulfanyl-4-propan-2-yl-1-(pyridin-4-ylmethyl)imidazol-2-yl]ethyl acetate Traditional Name: acetic acid 1-[4-isopropyl-5-(phenylthio)-1-(4-pyridylmethyl)imidazol-2-yl]ethyl ester Formula: C22H25N3O2S MolecularWeight: 395.5178

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(N(C(=N1)C(C)OC(=O)C)CC2=CC=NC=C2)SC3=CC=CC=C3

Isomeric SMILES

CC(C)C1=C(N(C(=N1)C(C)OC(=O)C)CC2=CC=NC=C2)SC3=CC=CC=C3

InChI

InChI=1S/C22H25N3O2S/c1-15(2)20-22(28-19-8-6-5-7-9-19)25(14-18-10-12-23-13-11-18)21(24-20)16(3)27-17(4)26/h5-13,15-16H,14H2,1-4H3