1,3-benzothiazol-2-ylmethyl 3-(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)propanoate

Systemtic Name: 1,3-benzothiazol-2-ylmethyl 3-(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)propanoate Openeye Name: 1,3-benzothiazol-2-ylmethyl 3-[3-(2-thienyl)-1,2,4-oxadiazol-5-yl]propanoate CAS Name: 3-(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)propanoic acid 1,3-benzothiazol-2-ylmethyl ester IUPAC Name: 1,3-benzothiazol-2-ylmethyl 3-(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)propanoate Traditional Name: 3-[3-(2-thienyl)-1,2,4-oxadiazol-5-yl]propionic acid 1,3-benzothiazol-2-ylmethyl ester Formula: C17H13N3O3S2 MolecularWeight: 371.43342

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)COC(=O)CCC3=NC(=NO3)C4=CC=CS4

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)COC(=O)CCC3=NC(=NO3)C4=CC=CS4

InChI

InChI=1S/C17H13N3O3S2/c21-16(22-10-15-18-11-4-1-2-5-12(11)25-15)8-7-14-19-17(20-23-14)13-6-3-9-24-13/h1-6,9H,7-8,10H2