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

Systemtic Name: S-[4-oxidanylidene-1-(4-phenylphenyl)-4-piperidin-1-yl-butyl] ethanethioate Openeye Name: S-[4-oxo-1-(4-phenylphenyl)-4-(1-piperidyl)butyl] ethanethioate CAS Name: ethanethioic acid S-[4-oxo-1-(4-phenylphenyl)-4-(1-piperidinyl)butyl] ester IUPAC Name: S-[4-oxo-1-(4-phenylphenyl)-4-piperidin-1-ylbutyl] ethanethioate Traditional Name: ethanethioic acid S-[4-keto-1-(4-phenylphenyl)-4-piperidino-butyl] ester Formula: C23H27NO2S MolecularWeight: 381.53098

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)SC(CCC(=O)N1CCCCC1)C2=CC=C(C=C2)C3=CC=CC=C3

Isomeric SMILES

CC(=O)SC(CCC(=O)N1CCCCC1)C2=CC=C(C=C2)C3=CC=CC=C3

InChI

InChI=1S/C23H27NO2S/c1-18(25)27-22(14-15-23(26)24-16-6-3-7-17-24)21-12-10-20(11-13-21)19-8-4-2-5-9-19/h2,4-5,8-13,22H,3,6-7,14-17H2,1H3