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

Systemtic Name: S-[4-(methylamino)-4-oxidanylidene-1-(4-phenylphenyl)butyl] ethanethioate Openeye Name: S-[4-(methylamino)-4-oxo-1-(4-phenylphenyl)butyl] ethanethioate CAS Name: ethanethioic acid S-[4-(methylamino)-4-oxo-1-(4-phenylphenyl)butyl] ester IUPAC Name: S-[4-(methylamino)-4-oxo-1-(4-phenylphenyl)butyl] ethanethioate Traditional Name: ethanethioic acid S-[4-keto-4-(methylamino)-1-(4-phenylphenyl)butyl] ester Formula: C19H21NO2S MolecularWeight: 327.44054

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)SC(CCC(=O)NC)C1=CC=C(C=C1)C2=CC=CC=C2

Isomeric SMILES

CC(=O)SC(CCC(=O)NC)C1=CC=C(C=C1)C2=CC=CC=C2

InChI

InChI=1S/C19H21NO2S/c1-14(21)23-18(12-13-19(22)20-2)17-10-8-16(9-11-17)15-6-4-3-5-7-15/h3-11,18H,12-13H2,1-2H3,(H,20,22)