N-(6-butyl-1,3-benzothiazol-2-yl)-3-(3-thiophen-3-yl-1,2,4-oxadiazol-5-yl)propanamide

Systemtic Name: N-(6-butyl-1,3-benzothiazol-2-yl)-3-(3-thiophen-3-yl-1,2,4-oxadiazol-5-yl)propanamide Openeye Name: N-(6-butyl-1,3-benzothiazol-2-yl)-3-[3-(3-thienyl)-1,2,4-oxadiazol-5-yl]propanamide CAS Name: N-(6-butyl-1,3-benzothiazol-2-yl)-3-[3-(3-thiophenyl)-1,2,4-oxadiazol-5-yl]propanamide IUPAC Name: N-(6-butyl-1,3-benzothiazol-2-yl)-3-(3-thiophen-3-yl-1,2,4-oxadiazol-5-yl)propanamide Traditional Name: N-(6-butyl-1,3-benzothiazol-2-yl)-3-[3-(3-thienyl)-1,2,4-oxadiazol-5-yl]propionamide Formula: C20H20N4O2S2 MolecularWeight: 412.5284

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC2=C(C=C1)N=C(S2)NC(=O)CCC3=NC(=NO3)C4=CSC=C4

Isomeric SMILES

CCCCC1=CC2=C(C=C1)N=C(S2)NC(=O)CCC3=NC(=NO3)C4=CSC=C4

InChI

InChI=1S/C20H20N4O2S2/c1-2-3-4-13-5-6-15-16(11-13)28-20(21-15)22-17(25)7-8-18-23-19(24-26-18)14-9-10-27-12-14/h5-6,9-12H,2-4,7-8H2,1H3,(H,21,22,25)