(2-phenylazanyl-1,3-thiazol-4-yl)methyl 2-phenylquinoline-4-carboxylate

Systemtic Name: (2-phenylazanyl-1,3-thiazol-4-yl)methyl 2-phenylquinoline-4-carboxylate Openeye Name: (2-anilinothiazol-4-yl)methyl 2-phenylquinoline-4-carboxylate CAS Name: 2-phenyl-4-quinolinecarboxylic acid (2-anilino-4-thiazolyl)methyl ester IUPAC Name: (2-anilino-1,3-thiazol-4-yl)methyl 2-phenylquinoline-4-carboxylate Traditional Name: 2-phenylcinchoninic acid (2-anilinothiazol-4-yl)methyl ester Formula: C26H19N3O2S MolecularWeight: 437.51296

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)OCC4=CSC(=N4)NC5=CC=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)OCC4=CSC(=N4)NC5=CC=CC=C5

InChI

InChI=1S/C26H19N3O2S/c30-25(31-16-20-17-32-26(28-20)27-19-11-5-2-6-12-19)22-15-24(18-9-3-1-4-10-18)29-23-14-8-7-13-21(22)23/h1-15,17H,16H2,(H,27,28)