(5-chloranyl-1,2,3-thiadiazol-4-yl)methyl 2-[(2-ethoxyphenyl)carbonylamino]-3-methyl-butanoate

Systemtic Name: (5-chloranyl-1,2,3-thiadiazol-4-yl)methyl 2-[(2-ethoxyphenyl)carbonylamino]-3-methyl-butanoate Openeye Name: (5-chlorothiadiazol-4-yl)methyl 2-[(2-ethoxybenzoyl)amino]-3-methyl-butanoate CAS Name: 2-[[(2-ethoxyphenyl)-oxomethyl]amino]-3-methylbutanoic acid (5-chloro-4-thiadiazolyl)methyl ester IUPAC Name: (5-chlorothiadiazol-4-yl)methyl 2-[(2-ethoxybenzoyl)amino]-3-methylbutanoate Traditional Name: 2-[(2-ethoxybenzoyl)amino]-3-methyl-butyric acid (5-chlorothiadiazol-4-yl)methyl ester Formula: C17H20ClN3O4S MolecularWeight: 397.8764

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1C(=O)NC(C(C)C)C(=O)OCC2=C(SN=N2)Cl

Isomeric SMILES

CCOC1=CC=CC=C1C(=O)NC(C(C)C)C(=O)OCC2=C(SN=N2)Cl

InChI

InChI=1S/C17H20ClN3O4S/c1-4-24-13-8-6-5-7-11(13)16(22)19-14(10(2)3)17(23)25-9-12-15(18)26-21-20-12/h5-8,10,14H,4,9H2,1-3H3,(H,19,22)