1-[2-(3-chlorophenyl)sulfanyl-4-propan-2-yl-5-(pyridin-4-ylmethyl)imidazol-2-yl]ethyl ethanoate

Systemtic Name: 1-[2-(3-chlorophenyl)sulfanyl-4-propan-2-yl-5-(pyridin-4-ylmethyl)imidazol-2-yl]ethyl ethanoate Openeye Name: 1-[2-(3-chlorophenyl)sulfanyl-4-isopropyl-5-(4-pyridylmethyl)imidazol-2-yl]ethyl acetate CAS Name: acetic acid 1-[2-[(3-chlorophenyl)thio]-4-propan-2-yl-5-(pyridin-4-ylmethyl)-2-imidazolyl]ethyl ester IUPAC Name: 1-[2-(3-chlorophenyl)sulfanyl-4-propan-2-yl-5-(pyridin-4-ylmethyl)imidazol-2-yl]ethyl acetate Traditional Name: acetic acid 1-[2-[(3-chlorophenyl)thio]-4-isopropyl-5-(4-pyridylmethyl)imidazol-2-yl]ethyl ester Formula: C22H24ClN3O2S MolecularWeight: 429.96286

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NC(N=C1CC2=CC=NC=C2)(C(C)OC(=O)C)SC3=CC(=CC=C3)Cl

Isomeric SMILES

CC(C)C1=NC(N=C1CC2=CC=NC=C2)(C(C)OC(=O)C)SC3=CC(=CC=C3)Cl

InChI

InChI=1S/C22H24ClN3O2S/c1-14(2)21-20(12-17-8-10-24-11-9-17)25-22(26-21,15(3)28-16(4)27)29-19-7-5-6-18(23)13-19/h5-11,13-15H,12H2,1-4H3