N-[6-bromanyl-3-(2-ethoxyethyl)-1,3-benzothiazol-2-ylidene]-1-methyl-pyrazole-3-carboxamide

Systemtic Name: N-[6-bromanyl-3-(2-ethoxyethyl)-1,3-benzothiazol-2-ylidene]-1-methyl-pyrazole-3-carboxamide Openeye Name: N-[6-bromo-3-(2-ethoxyethyl)-1,3-benzothiazol-2-ylidene]-1-methyl-pyrazole-3-carboxamide CAS Name: N-[6-bromo-3-(2-ethoxyethyl)-1,3-benzothiazol-2-ylidene]-1-methyl-3-pyrazolecarboxamide IUPAC Name: N-[6-bromo-3-(2-ethoxyethyl)-1,3-benzothiazol-2-ylidene]-1-methylpyrazole-3-carboxamide Traditional Name: N-[6-bromo-3-(2-ethoxyethyl)-1,3-benzothiazol-2-ylidene]-1-methyl-pyrazole-3-carboxamide Formula: C16H17BrN4O2S MolecularWeight: 409.30078

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H17BrN4O2S/c1-3-23-9-8-21-13-5-4-11(17)10-14(13)24-16(21)18-15(22)12-6-7-20(2)19-12/h4-7,10H,3,8-9H2,1-2H3