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

Systemtic Name: N-[2-[3-[2-[(2-fluorophenyl)amino]-2-oxidanylidene-ethyl]sulfanylindol-1-yl]ethyl]-3,5-dimethyl-benzamide Openeye Name: N-[2-[3-[2-(2-fluoroanilino)-2-oxo-ethyl]sulfanylindol-1-yl]ethyl]-3,5-dimethyl-benzamide CAS Name: N-[2-[3-[[2-(2-fluoroanilino)-2-oxoethyl]thio]-1-indolyl]ethyl]-3,5-dimethylbenzamide IUPAC Name: N-[2-[3-[2-(2-fluoroanilino)-2-oxoethyl]sulfanylindol-1-yl]ethyl]-3,5-dimethylbenzamide Traditional Name: N-[2-[3-[[2-(2-fluoroanilino)-2-keto-ethyl]thio]indol-1-yl]ethyl]-3,5-dimethyl-benzamide Formula: C27H26FN3O2S MolecularWeight: 475.577643

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)C(=O)NCCN2C=C(C3=CC=CC=C32)SCC(=O)NC4=CC=CC=C4F)C

Isomeric SMILES

CC1=CC(=CC(=C1)C(=O)NCCN2C=C(C3=CC=CC=C32)SCC(=O)NC4=CC=CC=C4F)C

InChI

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