3-chloranyl-N-[(E)-(1,3-diphenylpyrazol-4-yl)methylideneamino]-6-methoxy-1-benzothiophene-2-carboxamide

Systemtic Name: 3-chloranyl-N-[(E)-(1,3-diphenylpyrazol-4-yl)methylideneamino]-6-methoxy-1-benzothiophene-2-carboxamide Openeye Name: 3-chloro-N-[(E)-(1,3-diphenylpyrazol-4-yl)methyleneamino]-6-methoxy-benzothiophene-2-carboxamide CAS Name: 3-chloro-N-[(E)-(1,3-diphenyl-4-pyrazolyl)methylideneamino]-6-methoxy-1-benzothiophene-2-carboxamide IUPAC Name: 3-chloro-N-[(E)-(1,3-diphenylpyrazol-4-yl)methylideneamino]-6-methoxy-1-benzothiophene-2-carboxamide Traditional Name: 3-chloro-N-[(E)-(1,3-diphenylpyrazol-4-yl)methyleneamino]-6-methoxy-benzothiophene-2-carboxamide Formula: C26H19ClN4O2S MolecularWeight: 486.97266

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C(=C(S2)C(=O)NN=CC3=CN(N=C3C4=CC=CC=C4)C5=CC=CC=C5)Cl

Isomeric SMILES

COC1=CC2=C(C=C1)C(=C(S2)C(=O)N/N=C/C3=CN(N=C3C4=CC=CC=C4)C5=CC=CC=C5)Cl

InChI

InChI=1S/C26H19ClN4O2S/c1-33-20-12-13-21-22(14-20)34-25(23(21)27)26(32)29-28-15-18-16-31(19-10-6-3-7-11-19)30-24(18)17-8-4-2-5-9-17/h2-16H,1H3,(H,29,32)/b28-15+