[2-methoxy-4-[(E)-(pyrazin-2-ylcarbonylhydrazinylidene)methyl]phenyl] 3-chloranyl-1-benzothiophene-2-carboxylate

Systemtic Name: [2-methoxy-4-[(E)-(pyrazin-2-ylcarbonylhydrazinylidene)methyl]phenyl] 3-chloranyl-1-benzothiophene-2-carboxylate Openeye Name: [2-methoxy-4-[(E)-(pyrazine-2-carbonylhydrazono)methyl]phenyl] 3-chlorobenzothiophene-2-carboxylate CAS Name: 3-chloro-1-benzothiophene-2-carboxylic acid [2-methoxy-4-[(E)-[[oxo(2-pyrazinyl)methyl]hydrazinylidene]methyl]phenyl] ester IUPAC Name: [2-methoxy-4-[(E)-(pyrazine-2-carbonylhydrazinylidene)methyl]phenyl] 3-chloro-1-benzothiophene-2-carboxylate Traditional Name: 3-chlorobenzothiophene-2-carboxylic acid [2-methoxy-4-[(E)-(pyrazinoylhydrazono)methyl]phenyl] ester Formula: C22H15ClN4O4S MolecularWeight: 466.8969

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C=NNC(=O)C2=NC=CN=C2)OC(=O)C3=C(C4=CC=CC=C4S3)Cl

Isomeric SMILES

COC1=C(C=CC(=C1)/C=N/NC(=O)C2=NC=CN=C2)OC(=O)C3=C(C4=CC=CC=C4S3)Cl

InChI

InChI=1S/C22H15ClN4O4S/c1-30-17-10-13(11-26-27-21(28)15-12-24-8-9-25-15)6-7-16(17)31-22(29)20-19(23)14-4-2-3-5-18(14)32-20/h2-12H,1H3,(H,27,28)/b26-11+