[4-[(E)-(1,3-benzothiazol-2-ylhydrazinylidene)methyl]phenyl] pyridine-3-carboxylate

Systemtic Name: [4-[(E)-(1,3-benzothiazol-2-ylhydrazinylidene)methyl]phenyl] pyridine-3-carboxylate Openeye Name: [4-[(E)-(1,3-benzothiazol-2-ylhydrazono)methyl]phenyl] pyridine-3-carboxylate CAS Name: 3-pyridinecarboxylic acid [4-[(E)-(1,3-benzothiazol-2-ylhydrazinylidene)methyl]phenyl] ester IUPAC Name: [4-[(E)-(1,3-benzothiazol-2-ylhydrazinylidene)methyl]phenyl] pyridine-3-carboxylate Traditional Name: nicotinic acid [4-[(E)-(1,3-benzothiazol-2-ylhydrazono)methyl]phenyl] ester Formula: C20H14N4O2S MolecularWeight: 374.41576

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)NN=CC3=CC=C(C=C3)OC(=O)C4=CN=CC=C4

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)N/N=C/C3=CC=C(C=C3)OC(=O)C4=CN=CC=C4

InChI

InChI=1S/C20H14N4O2S/c25-19(15-4-3-11-21-13-15)26-16-9-7-14(8-10-16)12-22-24-20-23-17-5-1-2-6-18(17)27-20/h1-13H,(H,23,24)/b22-12+