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

Systemtic Name: N-[1-[5-[2-[(2,5-dimethylphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-4-prop-2-enyl-1,2,4-triazol-3-yl]ethyl]-2-fluoranyl-benzamide Openeye Name: N-[1-[4-allyl-5-[2-(2,5-dimethylanilino)-2-oxo-ethyl]sulfanyl-1,2,4-triazol-3-yl]ethyl]-2-fluoro-benzamide CAS Name: N-[1-[5-[[2-(2,5-dimethylanilino)-2-oxoethyl]thio]-4-prop-2-enyl-1,2,4-triazol-3-yl]ethyl]-2-fluorobenzamide IUPAC Name: N-[1-[5-[2-(2,5-dimethylanilino)-2-oxoethyl]sulfanyl-4-prop-2-enyl-1,2,4-triazol-3-yl]ethyl]-2-fluorobenzamide Traditional Name: N-[1-[4-allyl-5-[[2-(2,5-dimethylanilino)-2-keto-ethyl]thio]-1,2,4-triazol-3-yl]ethyl]-2-fluoro-benzamide Formula: C24H26FN5O2S MolecularWeight: 467.558943

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)NC(=O)CSC2=NN=C(N2CC=C)C(C)NC(=O)C3=CC=CC=C3F

Isomeric SMILES

CC1=CC(=C(C=C1)C)NC(=O)CSC2=NN=C(N2CC=C)C(C)NC(=O)C3=CC=CC=C3F

InChI

InChI=1S/C24H26FN5O2S/c1-5-12-30-22(17(4)26-23(32)18-8-6-7-9-19(18)25)28-29-24(30)33-14-21(31)27-20-13-15(2)10-11-16(20)3/h5-11,13,17H,1,12,14H2,2-4H3,(H,26,32)(H,27,31)