N-[2-[3-[2-[(4-ethylphenyl)amino]-2-oxidanylidene-ethyl]sulfanylindol-1-yl]ethyl]-2,6-bis(fluoranyl)benzamide

Systemtic Name: N-[2-[3-[2-[(4-ethylphenyl)amino]-2-oxidanylidene-ethyl]sulfanylindol-1-yl]ethyl]-2,6-bis(fluoranyl)benzamide Openeye Name: N-[2-[3-[2-(4-ethylanilino)-2-oxo-ethyl]sulfanylindol-1-yl]ethyl]-2,6-difluoro-benzamide CAS Name: N-[2-[3-[[2-(4-ethylanilino)-2-oxoethyl]thio]-1-indolyl]ethyl]-2,6-difluorobenzamide IUPAC Name: N-[2-[3-[2-(4-ethylanilino)-2-oxoethyl]sulfanylindol-1-yl]ethyl]-2,6-difluorobenzamide Traditional Name: N-[2-[3-[[2-(4-ethylanilino)-2-keto-ethyl]thio]indol-1-yl]ethyl]-2,6-difluoro-benzamide Formula: C27H25F2N3O2S MolecularWeight: 493.568106

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)NC(=O)CSC2=CN(C3=CC=CC=C32)CCNC(=O)C4=C(C=CC=C4F)F

Isomeric SMILES

CCC1=CC=C(C=C1)NC(=O)CSC2=CN(C3=CC=CC=C32)CCNC(=O)C4=C(C=CC=C4F)F

InChI

InChI=1S/C27H25F2N3O2S/c1-2-18-10-12-19(13-11-18)31-25(33)17-35-24-16-32(23-9-4-3-6-20(23)24)15-14-30-27(34)26-21(28)7-5-8-22(26)29/h3-13,16H,2,14-15,17H2,1H3,(H,30,34)(H,31,33)