N-[(E)-[1-phenyl-3-(4-phenylmethoxyphenyl)pyrazol-4-yl]methylideneamino]thiophene-2-carboxamide

Systemtic Name: N-[(E)-[1-phenyl-3-(4-phenylmethoxyphenyl)pyrazol-4-yl]methylideneamino]thiophene-2-carboxamide Openeye Name: N-[(E)-[3-(4-benzyloxyphenyl)-1-phenyl-pyrazol-4-yl]methyleneamino]thiophene-2-carboxamide CAS Name: N-[(E)-[1-phenyl-3-(4-phenylmethoxyphenyl)-4-pyrazolyl]methylideneamino]-2-thiophenecarboxamide IUPAC Name: N-[(E)-[1-phenyl-3-(4-phenylmethoxyphenyl)pyrazol-4-yl]methylideneamino]thiophene-2-carboxamide Traditional Name: N-[(E)-[3-(4-benzoxyphenyl)-1-phenyl-pyrazol-4-yl]methyleneamino]thiophene-2-carboxamide Formula: C28H22N4O2S MolecularWeight: 478.56488

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=CC=C(C=C2)C3=NN(C=C3C=NNC(=O)C4=CC=CS4)C5=CC=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)COC2=CC=C(C=C2)C3=NN(C=C3/C=N/NC(=O)C4=CC=CS4)C5=CC=CC=C5

InChI

InChI=1S/C28H22N4O2S/c33-28(26-12-7-17-35-26)30-29-18-23-19-32(24-10-5-2-6-11-24)31-27(23)22-13-15-25(16-14-22)34-20-21-8-3-1-4-9-21/h1-19H,20H2,(H,30,33)/b29-18+