N-[5-(1,3-benzodioxol-5-ylmethyl)-4-methyl-1,3-thiazol-2-yl]-4-bromanyl-2-fluoranyl-benzamide

Systemtic Name: N-[5-(1,3-benzodioxol-5-ylmethyl)-4-methyl-1,3-thiazol-2-yl]-4-bromanyl-2-fluoranyl-benzamide Openeye Name: N-[5-(1,3-benzodioxol-5-ylmethyl)-4-methyl-thiazol-2-yl]-4-bromo-2-fluoro-benzamide CAS Name: N-[5-(1,3-benzodioxol-5-ylmethyl)-4-methyl-2-thiazolyl]-4-bromo-2-fluorobenzamide IUPAC Name: N-[5-(1,3-benzodioxol-5-ylmethyl)-4-methyl-1,3-thiazol-2-yl]-4-bromo-2-fluorobenzamide Traditional Name: 4-bromo-2-fluoro-N-(4-methyl-5-piperonyl-thiazol-2-yl)benzamide Formula: C19H14BrFN2O3S MolecularWeight: 449.293463

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)NC(=O)C2=C(C=C(C=C2)Br)F)CC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CC1=C(SC(=N1)NC(=O)C2=C(C=C(C=C2)Br)F)CC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C19H14BrFN2O3S/c1-10-17(7-11-2-5-15-16(6-11)26-9-25-15)27-19(22-10)23-18(24)13-4-3-12(20)8-14(13)21/h2-6,8H,7,9H2,1H3,(H,22,23,24)