S-[4-(cyclopropylamino)-4-oxidanylidene-1-(4-phenylphenyl)butan-2-yl] ethanethioate

Systemtic Name: S-[4-(cyclopropylamino)-4-oxidanylidene-1-(4-phenylphenyl)butan-2-yl] ethanethioate Openeye Name: S-[3-(cyclopropylamino)-3-oxo-1-[(4-phenylphenyl)methyl]propyl] ethanethioate CAS Name: ethanethioic acid S-[4-(cyclopropylamino)-4-oxo-1-(4-phenylphenyl)butan-2-yl] ester IUPAC Name: S-[4-(cyclopropylamino)-4-oxo-1-(4-phenylphenyl)butan-2-yl] ethanethioate Traditional Name: ethanethioic acid S-[3-(cyclopropylamino)-3-keto-1-(4-phenylbenzyl)propyl] ester Formula: C21H23NO2S MolecularWeight: 353.47782

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)SC(CC1=CC=C(C=C1)C2=CC=CC=C2)CC(=O)NC3CC3

Isomeric SMILES

CC(=O)SC(CC1=CC=C(C=C1)C2=CC=CC=C2)CC(=O)NC3CC3

InChI

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