N-(1,3-benzothiazol-2-yl)-2-pyrimidin-2-ylsulfanyl-butanamide

Systemtic Name: N-(1,3-benzothiazol-2-yl)-2-pyrimidin-2-ylsulfanyl-butanamide Openeye Name: N-(1,3-benzothiazol-2-yl)-2-pyrimidin-2-ylsulfanyl-butanamide CAS Name: N-(1,3-benzothiazol-2-yl)-2-(2-pyrimidinylthio)butanamide IUPAC Name: N-(1,3-benzothiazol-2-yl)-2-pyrimidin-2-ylsulfanylbutanamide Traditional Name: N-(1,3-benzothiazol-2-yl)-2-(2-pyrimidylthio)butyramide Formula: C15H14N4OS2 MolecularWeight: 330.42786

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=NC2=CC=CC=C2S1)SC3=NC=CC=N3

Isomeric SMILES

CCC(C(=O)NC1=NC2=CC=CC=C2S1)SC3=NC=CC=N3

InChI

InChI=1S/C15H14N4OS2/c1-2-11(21-14-16-8-5-9-17-14)13(20)19-15-18-10-6-3-4-7-12(10)22-15/h3-9,11H,2H2,1H3,(H,18,19,20)