4-bromanyl-N-[5-(4-methoxyphenyl)-4-prop-2-enyl-1,3,4-thiadiazin-2-yl]benzamide hydrobromide

Systemtic Name: 4-bromanyl-N-[5-(4-methoxyphenyl)-4-prop-2-enyl-1,3,4-thiadiazin-2-yl]benzamide hydrobromide Openeye Name: N-[4-allyl-5-(4-methoxyphenyl)-1,3,4-thiadiazin-2-yl]-4-bromo-benzamide hydrobromide CAS Name: 4-bromo-N-[5-(4-methoxyphenyl)-4-prop-2-enyl-1,3,4-thiadiazin-2-yl]benzamide hydrobromide IUPAC Name: 4-bromo-N-[5-(4-methoxyphenyl)-4-prop-2-enyl-1,3,4-thiadiazin-2-yl]benzamide hydrobromide Traditional Name: N-[4-allyl-5-(4-methoxyphenyl)-1,3,4-thiadiazin-2-yl]-4-bromo-benzamide hydrobromide Formula: C20H19Br2N3O2S MolecularWeight: 525.25676

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=CSC(=NN2CC=C)NC(=O)C3=CC=C(C=C3)Br.Br

Isomeric SMILES

COC1=CC=C(C=C1)C2=CSC(=NN2CC=C)NC(=O)C3=CC=C(C=C3)Br.Br

InChI

InChI=1S/C20H18BrN3O2S.BrH/c1-3-12-24-18(14-6-10-17(26-2)11-7-14)13-27-20(23-24)22-19(25)15-4-8-16(21)9-5-15;/h3-11,13H,1,12H2,2H3,(H,22,23,25);1H