N-[(E)-(3-phenylmethoxyphenyl)methylideneamino]-5-thiophen-2-yl-1H-pyrazole-3-carboxamide

Systemtic Name: N-[(E)-(3-phenylmethoxyphenyl)methylideneamino]-5-thiophen-2-yl-1H-pyrazole-3-carboxamide Openeye Name: N-[(E)-(3-benzyloxyphenyl)methyleneamino]-5-(2-thienyl)-1H-pyrazole-3-carboxamide CAS Name: N-[(E)-(3-phenylmethoxyphenyl)methylideneamino]-5-thiophen-2-yl-1H-pyrazole-3-carboxamide IUPAC Name: N-[(E)-(3-phenylmethoxyphenyl)methylideneamino]-5-thiophen-2-yl-1H-pyrazole-3-carboxamide Traditional Name: N-[(E)-(3-benzoxybenzylidene)amino]-5-(2-thienyl)-1H-pyrazole-3-carboxamide Formula: C22H18N4O2S MolecularWeight: 402.46892

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=CC=CC(=C2)C=NNC(=O)C3=NNC(=C3)C4=CC=CS4

Isomeric SMILES

C1=CC=C(C=C1)COC2=CC=CC(=C2)/C=N/NC(=O)C3=NNC(=C3)C4=CC=CS4

InChI

InChI=1S/C22H18N4O2S/c27-22(20-13-19(24-25-20)21-10-5-11-29-21)26-23-14-17-8-4-9-18(12-17)28-15-16-6-2-1-3-7-16/h1-14H,15H2,(H,24,25)(H,26,27)/b23-14+