(5-chloranyl-1,2,3-thiadiazol-4-yl)methyl 2-[(4-tert-butylphenyl)carbonylamino]ethanoate

Systemtic Name: (5-chloranyl-1,2,3-thiadiazol-4-yl)methyl 2-[(4-tert-butylphenyl)carbonylamino]ethanoate Openeye Name: (5-chlorothiadiazol-4-yl)methyl 2-[(4-tert-butylbenzoyl)amino]acetate CAS Name: 2-[[(4-tert-butylphenyl)-oxomethyl]amino]acetic acid (5-chloro-4-thiadiazolyl)methyl ester IUPAC Name: (5-chlorothiadiazol-4-yl)methyl 2-[(4-tert-butylbenzoyl)amino]acetate Traditional Name: 2-[(4-tert-butylbenzoyl)amino]acetic acid (5-chlorothiadiazol-4-yl)methyl ester Formula: C16H18ClN3O3S MolecularWeight: 367.85042

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)NCC(=O)OCC2=C(SN=N2)Cl

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)NCC(=O)OCC2=C(SN=N2)Cl

InChI

InChI=1S/C16H18ClN3O3S/c1-16(2,3)11-6-4-10(5-7-11)15(22)18-8-13(21)23-9-12-14(17)24-20-19-12/h4-7H,8-9H2,1-3H3,(H,18,22)