ethyl 4-(2-imidazol-1-ylcarbothioyloxy-3,3-dimethyl-butoxy)benzoate

Systemtic Name: ethyl 4-(2-imidazol-1-ylcarbothioyloxy-3,3-dimethyl-butoxy)benzoate Openeye Name: ethyl 4-[2-(imidazole-1-carbothioyloxy)-3,3-dimethyl-butoxy]benzoate CAS Name: 4-[2-[1-imidazolyl(sulfanylidene)methoxy]-3,3-dimethylbutoxy]benzoic acid ethyl ester IUPAC Name: ethyl 4-[2-(imidazole-1-carbothioyloxy)-3,3-dimethylbutoxy]benzoate Traditional Name: 4-[2-(imidazole-1-carbothioyloxy)-3,3-dimethyl-butoxy]benzoic acid ethyl ester Formula: C19H24N2O4S MolecularWeight: 376.46986

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)OCC(C(C)(C)C)OC(=S)N2C=CN=C2

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)OCC(C(C)(C)C)OC(=S)N2C=CN=C2

InChI

InChI=1S/C19H24N2O4S/c1-5-23-17(22)14-6-8-15(9-7-14)24-12-16(19(2,3)4)25-18(26)21-11-10-20-13-21/h6-11,13,16H,5,12H2,1-4H3