3-bromanyl-N-[5-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-prop-2-enyl-1,3,4-thiadiazin-2-yl]benzamide

Systemtic Name: 3-bromanyl-N-[5-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-prop-2-enyl-1,3,4-thiadiazin-2-yl]benzamide Openeye Name: N-[4-allyl-5-(2,3-dihydro-1,4-benzodioxin-6-yl)-1,3,4-thiadiazin-2-yl]-3-bromo-benzamide CAS Name: 3-bromo-N-[5-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-prop-2-enyl-1,3,4-thiadiazin-2-yl]benzamide IUPAC Name: 3-bromo-N-[5-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-prop-2-enyl-1,3,4-thiadiazin-2-yl]benzamide Traditional Name: N-[4-allyl-5-(2,3-dihydro-1,4-benzodioxin-6-yl)-1,3,4-thiadiazin-2-yl]-3-bromo-benzamide Formula: C21H18BrN3O3S MolecularWeight: 472.35492

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=CSC(=N1)NC(=O)C2=CC(=CC=C2)Br)C3=CC4=C(C=C3)OCCO4

Isomeric SMILES

C=CCN1C(=CSC(=N1)NC(=O)C2=CC(=CC=C2)Br)C3=CC4=C(C=C3)OCCO4

InChI

InChI=1S/C21H18BrN3O3S/c1-2-8-25-17(14-6-7-18-19(12-14)28-10-9-27-18)13-29-21(24-25)23-20(26)15-4-3-5-16(22)11-15/h2-7,11-13H,1,8-10H2,(H,23,24,26)