[1-oxidanylidene-1-(4-phenylpiperazin-1-yl)propan-2-yl] 2-naphthalen-2-ylsulfanylethanoate

Systemtic Name: [1-oxidanylidene-1-(4-phenylpiperazin-1-yl)propan-2-yl] 2-naphthalen-2-ylsulfanylethanoate Openeye Name: [1-methyl-2-oxo-2-(4-phenylpiperazin-1-yl)ethyl] 2-(2-naphthylsulfanyl)acetate CAS Name: 2-(2-naphthalenylthio)acetic acid [1-oxo-1-(4-phenyl-1-piperazinyl)propan-2-yl] ester IUPAC Name: [1-oxo-1-(4-phenylpiperazin-1-yl)propan-2-yl] 2-naphthalen-2-ylsulfanylacetate Traditional Name: 2-(2-naphthylthio)acetic acid [2-keto-1-methyl-2-(4-phenylpiperazino)ethyl] ester Formula: C25H26N2O3S MolecularWeight: 434.55054

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCN(CC1)C2=CC=CC=C2)OC(=O)CSC3=CC4=CC=CC=C4C=C3

Isomeric SMILES

CC(C(=O)N1CCN(CC1)C2=CC=CC=C2)OC(=O)CSC3=CC4=CC=CC=C4C=C3

InChI

InChI=1S/C25H26N2O3S/c1-19(25(29)27-15-13-26(14-16-27)22-9-3-2-4-10-22)30-24(28)18-31-23-12-11-20-7-5-6-8-21(20)17-23/h2-12,17,19H,13-16,18H2,1H3