S-[3-chloranyl-3-oxidanylidene-2-[(4-phenylphenyl)methyl]propyl] ethanethioate

Systemtic Name: S-[3-chloranyl-3-oxidanylidene-2-[(4-phenylphenyl)methyl]propyl] ethanethioate Openeye Name: S-[3-chloro-3-oxo-2-[(4-phenylphenyl)methyl]propyl] ethanethioate CAS Name: ethanethioic acid S-[3-chloro-3-oxo-2-[(4-phenylphenyl)methyl]propyl] ester IUPAC Name: S-[3-chloro-3-oxo-2-[(4-phenylphenyl)methyl]propyl] ethanethioate Traditional Name: ethanethioic acid S-[3-chloro-3-keto-2-(4-phenylbenzyl)propyl] ester Formula: C18H17ClO2S MolecularWeight: 332.84438

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)SCC(CC1=CC=C(C=C1)C2=CC=CC=C2)C(=O)Cl

Isomeric SMILES

CC(=O)SCC(CC1=CC=C(C=C1)C2=CC=CC=C2)C(=O)Cl

InChI

InChI=1S/C18H17ClO2S/c1-13(20)22-12-17(18(19)21)11-14-7-9-16(10-8-14)15-5-3-2-4-6-15/h2-10,17H,11-12H2,1H3