N-[(E)-[3-[(3,5-dimethylpyrazol-1-yl)methyl]-4-methoxy-phenyl]methylideneamino]-1-benzothiophene-3-carboxamide

Systemtic Name: N-[(E)-[3-[(3,5-dimethylpyrazol-1-yl)methyl]-4-methoxy-phenyl]methylideneamino]-1-benzothiophene-3-carboxamide Openeye Name: N-[(E)-[3-[(3,5-dimethylpyrazol-1-yl)methyl]-4-methoxy-phenyl]methyleneamino]benzothiophene-3-carboxamide CAS Name: N-[(E)-[3-[(3,5-dimethyl-1-pyrazolyl)methyl]-4-methoxyphenyl]methylideneamino]-1-benzothiophene-3-carboxamide IUPAC Name: N-[(E)-[3-[(3,5-dimethylpyrazol-1-yl)methyl]-4-methoxyphenyl]methylideneamino]-1-benzothiophene-3-carboxamide Traditional Name: N-[(E)-[3-[(3,5-dimethylpyrazol-1-yl)methyl]-4-methoxy-benzylidene]amino]benzothiophene-3-carboxamide Formula: C23H22N4O2S MolecularWeight: 418.51138

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1CC2=C(C=CC(=C2)C=NNC(=O)C3=CSC4=CC=CC=C43)OC)C

Isomeric SMILES

CC1=CC(=NN1CC2=C(C=CC(=C2)/C=N/NC(=O)C3=CSC4=CC=CC=C43)OC)C

InChI

InChI=1S/C23H22N4O2S/c1-15-10-16(2)27(26-15)13-18-11-17(8-9-21(18)29-3)12-24-25-23(28)20-14-30-22-7-5-4-6-19(20)22/h4-12,14H,13H2,1-3H3,(H,25,28)/b24-12+