N-[6-ethyl-3-(2-methylsulfanylethyl)-1,3-benzothiazol-2-ylidene]-1,5-dimethyl-pyrazole-3-carboxamide

Systemtic Name: N-[6-ethyl-3-(2-methylsulfanylethyl)-1,3-benzothiazol-2-ylidene]-1,5-dimethyl-pyrazole-3-carboxamide Openeye Name: N-[6-ethyl-3-(2-methylsulfanylethyl)-1,3-benzothiazol-2-ylidene]-1,5-dimethyl-pyrazole-3-carboxamide CAS Name: N-[6-ethyl-3-[2-(methylthio)ethyl]-1,3-benzothiazol-2-ylidene]-1,5-dimethyl-3-pyrazolecarboxamide IUPAC Name: N-[6-ethyl-3-(2-methylsulfanylethyl)-1,3-benzothiazol-2-ylidene]-1,5-dimethylpyrazole-3-carboxamide Traditional Name: N-[6-ethyl-3-[2-(methylthio)ethyl]-1,3-benzothiazol-2-ylidene]-1,5-dimethyl-pyrazole-3-carboxamide Formula: C18H22N4OS2 MolecularWeight: 374.52348

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)N(C(=NC(=O)C3=NN(C(=C3)C)C)S2)CCSC

Isomeric SMILES

CCC1=CC2=C(C=C1)N(C(=NC(=O)C3=NN(C(=C3)C)C)S2)CCSC

InChI

InChI=1S/C18H22N4OS2/c1-5-13-6-7-15-16(11-13)25-18(22(15)8-9-24-4)19-17(23)14-10-12(2)21(3)20-14/h6-7,10-11H,5,8-9H2,1-4H3