(phenylmethyl) 2-imidazol-1-ylcarbothioyloxybicyclo[3.1.0]hexane-5-carboxylate

Systemtic Name: (phenylmethyl) 2-imidazol-1-ylcarbothioyloxybicyclo[3.1.0]hexane-5-carboxylate Openeye Name: benzyl 2-(imidazole-1-carbothioyloxy)bicyclo[3.1.0]hexane-5-carboxylate CAS Name: 2-[1-imidazolyl(sulfanylidene)methoxy]-5-bicyclo[3.1.0]hexanecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 2-(imidazole-1-carbothioyloxy)bicyclo[3.1.0]hexane-5-carboxylate Traditional Name: 2-(imidazole-1-carbothioyloxy)bicyclo[3.1.0]hexane-5-carboxylic acid benzyl ester Formula: C18H18N2O3S MolecularWeight: 342.41212

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2(CC2C1OC(=S)N3C=CN=C3)C(=O)OCC4=CC=CC=C4

Isomeric SMILES

C1CC2(CC2C1OC(=S)N3C=CN=C3)C(=O)OCC4=CC=CC=C4

InChI

InChI=1S/C18H18N2O3S/c21-16(22-11-13-4-2-1-3-5-13)18-7-6-15(14(18)10-18)23-17(24)20-9-8-19-12-20/h1-5,8-9,12,14-15H,6-7,10-11H2