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

Systemtic Name: 1-[4-phenylsulfanyl-2-propan-2-yl-5-(pyridin-4-ylmethyl)imidazol-2-yl]ethyl ethanoate Openeye Name: 1-[2-isopropyl-4-phenylsulfanyl-5-(4-pyridylmethyl)imidazol-2-yl]ethyl acetate CAS Name: acetic acid 1-[4-(phenylthio)-2-propan-2-yl-5-(pyridin-4-ylmethyl)-2-imidazolyl]ethyl ester IUPAC Name: 1-[4-phenylsulfanyl-2-propan-2-yl-5-(pyridin-4-ylmethyl)imidazol-2-yl]ethyl acetate Traditional Name: acetic acid 1-[2-isopropyl-4-(phenylthio)-5-(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(N=C(C(=N1)SC2=CC=CC=C2)CC3=CC=NC=C3)C(C)OC(=O)C

Isomeric SMILES

CC(C)C1(N=C(C(=N1)SC2=CC=CC=C2)CC3=CC=NC=C3)C(C)OC(=O)C

InChI

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