N-[2-[3-[2-[(2,5-dimethylphenyl)amino]-2-oxidanylidene-ethyl]sulfanylindol-1-yl]ethyl]-2-fluoranyl-benzamide

Systemtic Name: N-[2-[3-[2-[(2,5-dimethylphenyl)amino]-2-oxidanylidene-ethyl]sulfanylindol-1-yl]ethyl]-2-fluoranyl-benzamide Openeye Name: N-[2-[3-[2-(2,5-dimethylanilino)-2-oxo-ethyl]sulfanylindol-1-yl]ethyl]-2-fluoro-benzamide CAS Name: N-[2-[3-[[2-(2,5-dimethylanilino)-2-oxoethyl]thio]-1-indolyl]ethyl]-2-fluorobenzamide IUPAC Name: N-[2-[3-[2-(2,5-dimethylanilino)-2-oxoethyl]sulfanylindol-1-yl]ethyl]-2-fluorobenzamide Traditional Name: N-[2-[3-[[2-(2,5-dimethylanilino)-2-keto-ethyl]thio]indol-1-yl]ethyl]-2-fluoro-benzamide Formula: C27H26FN3O2S MolecularWeight: 475.577643

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)NC(=O)CSC2=CN(C3=CC=CC=C32)CCNC(=O)C4=CC=CC=C4F

Isomeric SMILES

CC1=CC(=C(C=C1)C)NC(=O)CSC2=CN(C3=CC=CC=C32)CCNC(=O)C4=CC=CC=C4F

InChI

InChI=1S/C27H26FN3O2S/c1-18-11-12-19(2)23(15-18)30-26(32)17-34-25-16-31(24-10-6-4-8-21(24)25)14-13-29-27(33)20-7-3-5-9-22(20)28/h3-12,15-16H,13-14,17H2,1-2H3,(H,29,33)(H,30,32)