2-bromanyl-N-[[4-methyl-5-[2-(naphthalen-2-ylamino)-2-oxidanylidene-ethyl]sulfanyl-1,2,4-triazol-3-yl]methyl]benzamide

Systemtic Name: 2-bromanyl-N-[[4-methyl-5-[2-(naphthalen-2-ylamino)-2-oxidanylidene-ethyl]sulfanyl-1,2,4-triazol-3-yl]methyl]benzamide Openeye Name: 2-bromo-N-[[4-methyl-5-[2-(2-naphthylamino)-2-oxo-ethyl]sulfanyl-1,2,4-triazol-3-yl]methyl]benzamide CAS Name: 2-bromo-N-[[4-methyl-5-[[2-(2-naphthalenylamino)-2-oxoethyl]thio]-1,2,4-triazol-3-yl]methyl]benzamide IUPAC Name: 2-bromo-N-[[4-methyl-5-[2-(naphthalen-2-ylamino)-2-oxoethyl]sulfanyl-1,2,4-triazol-3-yl]methyl]benzamide Traditional Name: 2-bromo-N-[[5-[[2-keto-2-(2-naphthylamino)ethyl]thio]-4-methyl-1,2,4-triazol-3-yl]methyl]benzamide Formula: C23H20BrN5O2S MolecularWeight: 510.4062

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1SCC(=O)NC2=CC3=CC=CC=C3C=C2)CNC(=O)C4=CC=CC=C4Br

Isomeric SMILES

CN1C(=NN=C1SCC(=O)NC2=CC3=CC=CC=C3C=C2)CNC(=O)C4=CC=CC=C4Br

InChI

InChI=1S/C23H20BrN5O2S/c1-29-20(13-25-22(31)18-8-4-5-9-19(18)24)27-28-23(29)32-14-21(30)26-17-11-10-15-6-2-3-7-16(15)12-17/h2-12H,13-14H2,1H3,(H,25,31)(H,26,30)