phenacyl 4-[2-(4-oxidanylidene-2-phenylazanyl-1,3-thiazol-5-yl)ethanoylamino]benzoate

Systemtic Name: phenacyl 4-[2-(4-oxidanylidene-2-phenylazanyl-1,3-thiazol-5-yl)ethanoylamino]benzoate Openeye Name: phenacyl 4-[[2-(2-anilino-4-oxo-thiazol-5-yl)acetyl]amino]benzoate CAS Name: 4-[[2-(2-anilino-4-oxo-5-thiazolyl)-1-oxoethyl]amino]benzoic acid phenacyl ester IUPAC Name: phenacyl 4-[[2-(2-anilino-4-oxo-1,3-thiazol-5-yl)acetyl]amino]benzoate Traditional Name: 4-[[2-(2-anilino-4-keto-2-thiazolin-5-yl)acetyl]amino]benzoic acid phenacyl ester Formula: C26H21N3O5S MolecularWeight: 487.52704

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)COC(=O)C2=CC=C(C=C2)NC(=O)CC3C(=O)N=C(S3)NC4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)C(=O)COC(=O)C2=CC=C(C=C2)NC(=O)CC3C(=O)N=C(S3)NC4=CC=CC=C4

InChI

InChI=1S/C26H21N3O5S/c30-21(17-7-3-1-4-8-17)16-34-25(33)18-11-13-20(14-12-18)27-23(31)15-22-24(32)29-26(35-22)28-19-9-5-2-6-10-19/h1-14,22H,15-16H2,(H,27,31)(H,28,29,32)