9H-fluoren-9-ylmethyl 4-(benzenecarbonothioylsulfanyl)-4-cyano-pentanoate

Systemtic Name: 9H-fluoren-9-ylmethyl 4-(benzenecarbonothioylsulfanyl)-4-cyano-pentanoate Openeye Name: 9H-fluoren-9-ylmethyl 4-(benzenecarbonothioylsulfanyl)-4-cyano-pentanoate CAS Name: 4-(benzenecarbonothioylthio)-4-cyanopentanoic acid 9H-fluoren-9-ylmethyl ester IUPAC Name: 9H-fluoren-9-ylmethyl 4-(benzenecarbonothioylsulfanyl)-4-cyanopentanoate Traditional Name: 4-(benzenecarbonothioylthio)-4-cyano-valeric acid 9H-fluoren-9-ylmethyl ester Formula: C27H23NO2S2 MolecularWeight: 457.60702

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC(=O)OCC1C2=CC=CC=C2C3=CC=CC=C13)(C#N)SC(=S)C4=CC=CC=C4

Isomeric SMILES

CC(CCC(=O)OCC1C2=CC=CC=C2C3=CC=CC=C13)(C#N)SC(=S)C4=CC=CC=C4

InChI

InChI=1S/C27H23NO2S2/c1-27(18-28,32-26(31)19-9-3-2-4-10-19)16-15-25(29)30-17-24-22-13-7-5-11-20(22)21-12-6-8-14-23(21)24/h2-14,24H,15-17H2,1H3