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

Systemtic Name: N-[3-(2-ethoxyethyl)-6-methylsulfonyl-1,3-benzothiazol-2-ylidene]-1,5-dimethyl-pyrazole-3-carboxamide Openeye Name: N-[3-(2-ethoxyethyl)-6-methylsulfonyl-1,3-benzothiazol-2-ylidene]-1,5-dimethyl-pyrazole-3-carboxamide CAS Name: N-[3-(2-ethoxyethyl)-6-methylsulfonyl-1,3-benzothiazol-2-ylidene]-1,5-dimethyl-3-pyrazolecarboxamide IUPAC Name: N-[3-(2-ethoxyethyl)-6-methylsulfonyl-1,3-benzothiazol-2-ylidene]-1,5-dimethylpyrazole-3-carboxamide Traditional Name: N-[3-(2-ethoxyethyl)-6-mesyl-1,3-benzothiazol-2-ylidene]-1,5-dimethyl-pyrazole-3-carboxamide Formula: C18H22N4O4S2 MolecularWeight: 422.52168

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCN1C2=C(C=C(C=C2)S(=O)(=O)C)SC1=NC(=O)C3=NN(C(=C3)C)C

Isomeric SMILES

CCOCCN1C2=C(C=C(C=C2)S(=O)(=O)C)SC1=NC(=O)C3=NN(C(=C3)C)C

InChI

InChI=1S/C18H22N4O4S2/c1-5-26-9-8-22-15-7-6-13(28(4,24)25)11-16(15)27-18(22)19-17(23)14-10-12(2)21(3)20-14/h6-7,10-11H,5,8-9H2,1-4H3