(2-thiophen-3-yl-1,3-thiazol-4-yl)methyl 4-(1,3-dithiolan-2-yl)benzoate

Systemtic Name: (2-thiophen-3-yl-1,3-thiazol-4-yl)methyl 4-(1,3-dithiolan-2-yl)benzoate Openeye Name: [2-(3-thienyl)thiazol-4-yl]methyl 4-(1,3-dithiolan-2-yl)benzoate CAS Name: 4-(1,3-dithiolan-2-yl)benzoic acid [2-(3-thiophenyl)-4-thiazolyl]methyl ester IUPAC Name: (2-thiophen-3-yl-1,3-thiazol-4-yl)methyl 4-(1,3-dithiolan-2-yl)benzoate Traditional Name: 4-(1,3-dithiolan-2-yl)benzoic acid [2-(3-thienyl)thiazol-4-yl]methyl ester Formula: C18H15NO2S4 MolecularWeight: 405.5772

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Descriptors Computed from Structure

Canonical SMILES:

C1CSC(S1)C2=CC=C(C=C2)C(=O)OCC3=CSC(=N3)C4=CSC=C4

Isomeric SMILES

C1CSC(S1)C2=CC=C(C=C2)C(=O)OCC3=CSC(=N3)C4=CSC=C4

InChI

InChI=1S/C18H15NO2S4/c20-17(12-1-3-13(4-2-12)18-23-7-8-24-18)21-9-15-11-25-16(19-15)14-5-6-22-10-14/h1-6,10-11,18H,7-9H2