(3-chloranyl-1-benzothiophen-2-yl)methyl 3-(3-thiophen-3-yl-1,2,4-oxadiazol-5-yl)propanoate

Systemtic Name: (3-chloranyl-1-benzothiophen-2-yl)methyl 3-(3-thiophen-3-yl-1,2,4-oxadiazol-5-yl)propanoate Openeye Name: (3-chlorobenzothiophen-2-yl)methyl 3-[3-(3-thienyl)-1,2,4-oxadiazol-5-yl]propanoate CAS Name: 3-[3-(3-thiophenyl)-1,2,4-oxadiazol-5-yl]propanoic acid (3-chloro-1-benzothiophen-2-yl)methyl ester IUPAC Name: (3-chloro-1-benzothiophen-2-yl)methyl 3-(3-thiophen-3-yl-1,2,4-oxadiazol-5-yl)propanoate Traditional Name: 3-[3-(3-thienyl)-1,2,4-oxadiazol-5-yl]propionic acid (3-chlorobenzothiophen-2-yl)methyl ester Formula: C18H13ClN2O3S2 MolecularWeight: 404.89042

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=C(S2)COC(=O)CCC3=NC(=NO3)C4=CSC=C4)Cl

Isomeric SMILES

C1=CC=C2C(=C1)C(=C(S2)COC(=O)CCC3=NC(=NO3)C4=CSC=C4)Cl

InChI

InChI=1S/C18H13ClN2O3S2/c19-17-12-3-1-2-4-13(12)26-14(17)9-23-16(22)6-5-15-20-18(21-24-15)11-7-8-25-10-11/h1-4,7-8,10H,5-6,9H2