S-[4-(cyclopropylamino)-4-oxidanylidene-1-(4-phenylphenyl)butyl] ethanethioate

Systemtic Name: S-[4-(cyclopropylamino)-4-oxidanylidene-1-(4-phenylphenyl)butyl] ethanethioate Openeye Name: S-[4-(cyclopropylamino)-4-oxo-1-(4-phenylphenyl)butyl] ethanethioate CAS Name: ethanethioic acid S-[4-(cyclopropylamino)-4-oxo-1-(4-phenylphenyl)butyl] ester IUPAC Name: S-[4-(cyclopropylamino)-4-oxo-1-(4-phenylphenyl)butyl] ethanethioate Traditional Name: ethanethioic acid S-[4-(cyclopropylamino)-4-keto-1-(4-phenylphenyl)butyl] ester Formula: C21H23NO2S MolecularWeight: 353.47782

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)SC(CCC(=O)NC1CC1)C2=CC=C(C=C2)C3=CC=CC=C3

Isomeric SMILES

CC(=O)SC(CCC(=O)NC1CC1)C2=CC=C(C=C2)C3=CC=CC=C3

InChI

InChI=1S/C21H23NO2S/c1-15(23)25-20(13-14-21(24)22-19-11-12-19)18-9-7-17(8-10-18)16-5-3-2-4-6-16/h2-10,19-20H,11-14H2,1H3,(H,22,24)