N-[2-[5-[2-[(2-ethoxyphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-4-prop-2-enyl-1,2,4-triazol-3-yl]ethyl]-2-fluoranyl-benzamide

Systemtic Name: N-[2-[5-[2-[(2-ethoxyphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-4-prop-2-enyl-1,2,4-triazol-3-yl]ethyl]-2-fluoranyl-benzamide Openeye Name: N-[2-[4-allyl-5-[2-(2-ethoxyanilino)-2-oxo-ethyl]sulfanyl-1,2,4-triazol-3-yl]ethyl]-2-fluoro-benzamide CAS Name: N-[2-[5-[[2-(2-ethoxyanilino)-2-oxoethyl]thio]-4-prop-2-enyl-1,2,4-triazol-3-yl]ethyl]-2-fluorobenzamide IUPAC Name: N-[2-[5-[2-(2-ethoxyanilino)-2-oxoethyl]sulfanyl-4-prop-2-enyl-1,2,4-triazol-3-yl]ethyl]-2-fluorobenzamide Traditional Name: N-[2-[4-allyl-5-[[2-keto-2-(o-phenetidino)ethyl]thio]-1,2,4-triazol-3-yl]ethyl]-2-fluoro-benzamide Formula: C24H26FN5O3S MolecularWeight: 483.558343

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1NC(=O)CSC2=NN=C(N2CC=C)CCNC(=O)C3=CC=CC=C3F

Isomeric SMILES

CCOC1=CC=CC=C1NC(=O)CSC2=NN=C(N2CC=C)CCNC(=O)C3=CC=CC=C3F

InChI

InChI=1S/C24H26FN5O3S/c1-3-15-30-21(13-14-26-23(32)17-9-5-6-10-18(17)25)28-29-24(30)34-16-22(31)27-19-11-7-8-12-20(19)33-4-2/h3,5-12H,1,4,13-16H2,2H3,(H,26,32)(H,27,31)