S-[2-(4-chlorophenyl)-4-oxidanylidene-3,3-diphenyl-1-propan-2-yl-azetidin-2-yl] ethanethioate

Systemtic Name: S-[2-(4-chlorophenyl)-4-oxidanylidene-3,3-diphenyl-1-propan-2-yl-azetidin-2-yl] ethanethioate Openeye Name: S-[2-(4-chlorophenyl)-1-isopropyl-4-oxo-3,3-diphenyl-azetidin-2-yl] ethanethioate CAS Name: ethanethioic acid S-[2-(4-chlorophenyl)-4-oxo-3,3-diphenyl-1-propan-2-yl-2-azetidinyl] ester IUPAC Name: S-[2-(4-chlorophenyl)-4-oxo-3,3-diphenyl-1-propan-2-ylazetidin-2-yl] ethanethioate Traditional Name: ethanethioic acid S-[2-(4-chlorophenyl)-1-isopropyl-4-keto-3,3-diphenyl-azetidin-2-yl] ester Formula: C26H24ClNO2S MolecularWeight: 449.99226

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C(=O)C(C1(C2=CC=C(C=C2)Cl)SC(=O)C)(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CC(C)N1C(=O)C(C1(C2=CC=C(C=C2)Cl)SC(=O)C)(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C26H24ClNO2S/c1-18(2)28-24(30)25(20-10-6-4-7-11-20,21-12-8-5-9-13-21)26(28,31-19(3)29)22-14-16-23(27)17-15-22/h4-18H,1-3H3