(5-phenyl-1,3-oxazol-2-yl)methyl 4-(1,3-dithian-2-yl)benzoate

Systemtic Name: (5-phenyl-1,3-oxazol-2-yl)methyl 4-(1,3-dithian-2-yl)benzoate Openeye Name: (5-phenyloxazol-2-yl)methyl 4-(1,3-dithian-2-yl)benzoate CAS Name: 4-(1,3-dithian-2-yl)benzoic acid (5-phenyl-2-oxazolyl)methyl ester IUPAC Name: (5-phenyl-1,3-oxazol-2-yl)methyl 4-(1,3-dithian-2-yl)benzoate Traditional Name: 4-(1,3-dithian-2-yl)benzoic acid (5-phenyloxazol-2-yl)methyl ester Formula: C21H19NO3S2 MolecularWeight: 397.51046

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Descriptors Computed from Structure

Canonical SMILES:

C1CSC(SC1)C2=CC=C(C=C2)C(=O)OCC3=NC=C(O3)C4=CC=CC=C4

Isomeric SMILES

C1CSC(SC1)C2=CC=C(C=C2)C(=O)OCC3=NC=C(O3)C4=CC=CC=C4

InChI

InChI=1S/C21H19NO3S2/c23-20(16-7-9-17(10-8-16)21-26-11-4-12-27-21)24-14-19-22-13-18(25-19)15-5-2-1-3-6-15/h1-3,5-10,13,21H,4,11-12,14H2