N-(1,3-benzodioxol-5-yl)-1-phenyl-3-thiophen-2-yl-pyrazole-4-carboxamide

Systemtic Name: N-(1,3-benzodioxol-5-yl)-1-phenyl-3-thiophen-2-yl-pyrazole-4-carboxamide Openeye Name: N-(1,3-benzodioxol-5-yl)-1-phenyl-3-(2-thienyl)pyrazole-4-carboxamide CAS Name: N-(1,3-benzodioxol-5-yl)-1-phenyl-3-thiophen-2-yl-4-pyrazolecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-yl)-1-phenyl-3-thiophen-2-ylpyrazole-4-carboxamide Traditional Name: N-(1,3-benzodioxol-5-yl)-1-phenyl-3-(2-thienyl)pyrazole-4-carboxamide Formula: C21H15N3O3S MolecularWeight: 389.4271

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)NC(=O)C3=CN(N=C3C4=CC=CS4)C5=CC=CC=C5

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)NC(=O)C3=CN(N=C3C4=CC=CS4)C5=CC=CC=C5

InChI

InChI=1S/C21H15N3O3S/c25-21(22-14-8-9-17-18(11-14)27-13-26-17)16-12-24(15-5-2-1-3-6-15)23-20(16)19-7-4-10-28-19/h1-12H,13H2,(H,22,25)