4-fluoranyl-N-[2-[3-[2-oxidanylidene-2-(4-phenylpiperazin-1-yl)ethyl]sulfanylindol-1-yl]ethyl]benzamide

Systemtic Name: 4-fluoranyl-N-[2-[3-[2-oxidanylidene-2-(4-phenylpiperazin-1-yl)ethyl]sulfanylindol-1-yl]ethyl]benzamide Openeye Name: 4-fluoro-N-[2-[3-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]sulfanylindol-1-yl]ethyl]benzamide CAS Name: 4-fluoro-N-[2-[3-[[2-oxo-2-(4-phenyl-1-piperazinyl)ethyl]thio]-1-indolyl]ethyl]benzamide IUPAC Name: 4-fluoro-N-[2-[3-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]sulfanylindol-1-yl]ethyl]benzamide Traditional Name: 4-fluoro-N-[2-[3-[[2-keto-2-(4-phenylpiperazino)ethyl]thio]indol-1-yl]ethyl]benzamide Formula: C29H29FN4O2S MolecularWeight: 516.629563

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=C2)C(=O)CSC3=CN(C4=CC=CC=C43)CCNC(=O)C5=CC=C(C=C5)F

Isomeric SMILES

C1CN(CCN1C2=CC=CC=C2)C(=O)CSC3=CN(C4=CC=CC=C43)CCNC(=O)C5=CC=C(C=C5)F

InChI

InChI=1S/C29H29FN4O2S/c30-23-12-10-22(11-13-23)29(36)31-14-15-34-20-27(25-8-4-5-9-26(25)34)37-21-28(35)33-18-16-32(17-19-33)24-6-2-1-3-7-24/h1-13,20H,14-19,21H2,(H,31,36)