butyl 4-[(2-phenylazanyl-1,3-thiazol-4-yl)carbonylamino]benzoate

Systemtic Name: butyl 4-[(2-phenylazanyl-1,3-thiazol-4-yl)carbonylamino]benzoate Openeye Name: butyl 4-[(2-anilinothiazole-4-carbonyl)amino]benzoate CAS Name: 4-[[(2-anilino-4-thiazolyl)-oxomethyl]amino]benzoic acid butyl ester IUPAC Name: butyl 4-[(2-anilino-1,3-thiazole-4-carbonyl)amino]benzoate Traditional Name: 4-[(2-anilinothiazole-4-carbonyl)amino]benzoic acid butyl ester Formula: C21H21N3O3S MolecularWeight: 395.47474

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)C2=CSC(=N2)NC3=CC=CC=C3

Isomeric SMILES

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)C2=CSC(=N2)NC3=CC=CC=C3

InChI

InChI=1S/C21H21N3O3S/c1-2-3-13-27-20(26)15-9-11-17(12-10-15)22-19(25)18-14-28-21(24-18)23-16-7-5-4-6-8-16/h4-12,14H,2-3,13H2,1H3,(H,22,25)(H,23,24)