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

Systemtic Name: N-[1-(1,3-benzodioxol-5-yl)ethyl]-1-phenyl-3-thiophen-2-yl-pyrazole-4-carboxamide Openeye Name: N-[1-(1,3-benzodioxol-5-yl)ethyl]-1-phenyl-3-(2-thienyl)pyrazole-4-carboxamide CAS Name: N-[1-(1,3-benzodioxol-5-yl)ethyl]-1-phenyl-3-thiophen-2-yl-4-pyrazolecarboxamide IUPAC Name: N-[1-(1,3-benzodioxol-5-yl)ethyl]-1-phenyl-3-thiophen-2-ylpyrazole-4-carboxamide Traditional Name: N-[1-(1,3-benzodioxol-5-yl)ethyl]-1-phenyl-3-(2-thienyl)pyrazole-4-carboxamide Formula: C23H19N3O3S MolecularWeight: 417.48026

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC2=C(C=C1)OCO2)NC(=O)C3=CN(N=C3C4=CC=CS4)C5=CC=CC=C5

Isomeric SMILES

CC(C1=CC2=C(C=C1)OCO2)NC(=O)C3=CN(N=C3C4=CC=CS4)C5=CC=CC=C5

InChI

InChI=1S/C23H19N3O3S/c1-15(16-9-10-19-20(12-16)29-14-28-19)24-23(27)18-13-26(17-6-3-2-4-7-17)25-22(18)21-8-5-11-30-21/h2-13,15H,14H2,1H3,(H,24,27)