(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)methyl 4-(1,3-benzothiazol-2-yl)butanoate

Systemtic Name: (3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)methyl 4-(1,3-benzothiazol-2-yl)butanoate Openeye Name: [3-(2-thienyl)-1,2,4-oxadiazol-5-yl]methyl 4-(1,3-benzothiazol-2-yl)butanoate CAS Name: 4-(1,3-benzothiazol-2-yl)butanoic acid (3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)methyl ester IUPAC Name: (3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)methyl 4-(1,3-benzothiazol-2-yl)butanoate Traditional Name: 4-(1,3-benzothiazol-2-yl)butyric acid [3-(2-thienyl)-1,2,4-oxadiazol-5-yl]methyl ester Formula: C18H15N3O3S2 MolecularWeight: 385.46

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)CCCC(=O)OCC3=NC(=NO3)C4=CC=CS4

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)CCCC(=O)OCC3=NC(=NO3)C4=CC=CS4

InChI

InChI=1S/C18H15N3O3S2/c22-17(9-3-8-16-19-12-5-1-2-6-13(12)26-16)23-11-15-20-18(21-24-15)14-7-4-10-25-14/h1-2,4-7,10H,3,8-9,11H2