2-[3-ethanoyl-5-(4-fluorophenyl)-2-methyl-pyrrol-1-yl]-N-(6-ethoxy-1,3-benzothiazol-2-yl)ethanamide

Systemtic Name: 2-[3-ethanoyl-5-(4-fluorophenyl)-2-methyl-pyrrol-1-yl]-N-(6-ethoxy-1,3-benzothiazol-2-yl)ethanamide Openeye Name: 2-[3-acetyl-5-(4-fluorophenyl)-2-methyl-pyrrol-1-yl]-N-(6-ethoxy-1,3-benzothiazol-2-yl)acetamide CAS Name: 2-[3-acetyl-5-(4-fluorophenyl)-2-methyl-1-pyrrolyl]-N-(6-ethoxy-1,3-benzothiazol-2-yl)acetamide IUPAC Name: 2-[3-acetyl-5-(4-fluorophenyl)-2-methylpyrrol-1-yl]-N-(6-ethoxy-1,3-benzothiazol-2-yl)acetamide Traditional Name: 2-[3-acetyl-5-(4-fluorophenyl)-2-methyl-pyrrol-1-yl]-N-(6-ethoxy-1,3-benzothiazol-2-yl)acetamide Formula: C24H22FN3O3S MolecularWeight: 451.513183

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)N=C(S2)NC(=O)CN3C(=C(C=C3C4=CC=C(C=C4)F)C(=O)C)C

Isomeric SMILES

CCOC1=CC2=C(C=C1)N=C(S2)NC(=O)CN3C(=C(C=C3C4=CC=C(C=C4)F)C(=O)C)C

InChI

InChI=1S/C24H22FN3O3S/c1-4-31-18-9-10-20-22(11-18)32-24(26-20)27-23(30)13-28-14(2)19(15(3)29)12-21(28)16-5-7-17(25)8-6-16/h5-12H,4,13H2,1-3H3,(H,26,27,30)