[4-[2-(3-azanyl-4-cyano-1H-pyrazol-5-yl)-2-cyano-ethenyl]-2-methoxy-phenyl] thiophene-2-carboxylate

Systemtic Name: [4-[2-(3-azanyl-4-cyano-1H-pyrazol-5-yl)-2-cyano-ethenyl]-2-methoxy-phenyl] thiophene-2-carboxylate Openeye Name: [4-[2-(3-amino-4-cyano-1H-pyrazol-5-yl)-2-cyano-vinyl]-2-methoxy-phenyl] thiophene-2-carboxylate CAS Name: 2-thiophenecarboxylic acid [4-[2-(3-amino-4-cyano-1H-pyrazol-5-yl)-2-cyanoethenyl]-2-methoxyphenyl] ester IUPAC Name: [4-[2-(3-amino-4-cyano-1H-pyrazol-5-yl)-2-cyanoethenyl]-2-methoxyphenyl] thiophene-2-carboxylate Traditional Name: thiophene-2-carboxylic acid [4-[2-(3-amino-4-cyano-1H-pyrazol-5-yl)-2-cyano-vinyl]-2-methoxy-phenyl] ester Formula: C19H13N5O3S MolecularWeight: 391.40322

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C=C(C#N)C2=C(C(=NN2)N)C#N)OC(=O)C3=CC=CS3

Isomeric SMILES

COC1=C(C=CC(=C1)C=C(C#N)C2=C(C(=NN2)N)C#N)OC(=O)C3=CC=CS3

InChI

InChI=1S/C19H13N5O3S/c1-26-15-8-11(4-5-14(15)27-19(25)16-3-2-6-28-16)7-12(9-20)17-13(10-21)18(22)24-23-17/h2-8H,1H3,(H3,22,23,24)