(2-phenyl-1,3-oxazol-4-yl)methyl 1-(1,3-benzothiazol-2-ylmethyl)cyclohexane-1-carboxylate

Systemtic Name: (2-phenyl-1,3-oxazol-4-yl)methyl 1-(1,3-benzothiazol-2-ylmethyl)cyclohexane-1-carboxylate Openeye Name: (2-phenyloxazol-4-yl)methyl 1-(1,3-benzothiazol-2-ylmethyl)cyclohexanecarboxylate CAS Name: 1-(1,3-benzothiazol-2-ylmethyl)-1-cyclohexanecarboxylic acid (2-phenyl-4-oxazolyl)methyl ester IUPAC Name: (2-phenyl-1,3-oxazol-4-yl)methyl 1-(1,3-benzothiazol-2-ylmethyl)cyclohexane-1-carboxylate Traditional Name: 1-(1,3-benzothiazol-2-ylmethyl)cyclohexanecarboxylic acid (2-phenyloxazol-4-yl)methyl ester Formula: C25H24N2O3S MolecularWeight: 432.53466

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)(CC2=NC3=CC=CC=C3S2)C(=O)OCC4=COC(=N4)C5=CC=CC=C5

Isomeric SMILES

C1CCC(CC1)(CC2=NC3=CC=CC=C3S2)C(=O)OCC4=COC(=N4)C5=CC=CC=C5

InChI

InChI=1S/C25H24N2O3S/c28-24(30-17-19-16-29-23(26-19)18-9-3-1-4-10-18)25(13-7-2-8-14-25)15-22-27-20-11-5-6-12-21(20)31-22/h1,3-6,9-12,16H,2,7-8,13-15,17H2