3-bromanyl-N-(6-butyl-1,3-benzothiazol-2-yl)-4-ethoxy-benzamide

Systemtic Name: 3-bromanyl-N-(6-butyl-1,3-benzothiazol-2-yl)-4-ethoxy-benzamide Openeye Name: 3-bromo-N-(6-butyl-1,3-benzothiazol-2-yl)-4-ethoxy-benzamide CAS Name: 3-bromo-N-(6-butyl-1,3-benzothiazol-2-yl)-4-ethoxybenzamide IUPAC Name: 3-bromo-N-(6-butyl-1,3-benzothiazol-2-yl)-4-ethoxybenzamide Traditional Name: 3-bromo-N-(6-butyl-1,3-benzothiazol-2-yl)-4-ethoxy-benzamide Formula: C20H21BrN2O2S MolecularWeight: 433.36194

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC2=C(C=C1)N=C(S2)NC(=O)C3=CC(=C(C=C3)OCC)Br

Isomeric SMILES

CCCCC1=CC2=C(C=C1)N=C(S2)NC(=O)C3=CC(=C(C=C3)OCC)Br

InChI

InChI=1S/C20H21BrN2O2S/c1-3-5-6-13-7-9-16-18(11-13)26-20(22-16)23-19(24)14-8-10-17(25-4-2)15(21)12-14/h7-12H,3-6H2,1-2H3,(H,22,23,24)