N-[4-(1,3-benzodioxol-5-yl)-1,3-thiazol-2-yl]-2-(1-phenylpyrazol-4-yl)ethanamide

Systemtic Name: N-[4-(1,3-benzodioxol-5-yl)-1,3-thiazol-2-yl]-2-(1-phenylpyrazol-4-yl)ethanamide Openeye Name: N-[4-(1,3-benzodioxol-5-yl)thiazol-2-yl]-2-(1-phenylpyrazol-4-yl)acetamide CAS Name: N-[4-(1,3-benzodioxol-5-yl)-2-thiazolyl]-2-(1-phenyl-4-pyrazolyl)acetamide IUPAC Name: N-[4-(1,3-benzodioxol-5-yl)-1,3-thiazol-2-yl]-2-(1-phenylpyrazol-4-yl)acetamide Traditional Name: N-[4-(1,3-benzodioxol-5-yl)thiazol-2-yl]-2-(1-phenylpyrazol-4-yl)acetamide Formula: C21H16N4O3S MolecularWeight: 404.44174

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C3=CSC(=N3)NC(=O)CC4=CN(N=C4)C5=CC=CC=C5

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C3=CSC(=N3)NC(=O)CC4=CN(N=C4)C5=CC=CC=C5

InChI

InChI=1S/C21H16N4O3S/c26-20(8-14-10-22-25(11-14)16-4-2-1-3-5-16)24-21-23-17(12-29-21)15-6-7-18-19(9-15)28-13-27-18/h1-7,9-12H,8,13H2,(H,23,24,26)