N-(6-methoxy-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-1,4-dimethyl-pyrazole-3-carboxamide

Systemtic Name: N-(6-methoxy-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-1,4-dimethyl-pyrazole-3-carboxamide Openeye Name: N-(6-methoxy-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-1,4-dimethyl-pyrazole-3-carboxamide CAS Name: N-(6-methoxy-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-1,4-dimethyl-3-pyrazolecarboxamide IUPAC Name: N-(6-methoxy-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-1,4-dimethylpyrazole-3-carboxamide Traditional Name: N-(6-methoxy-3-propargyl-1,3-benzothiazol-2-ylidene)-1,4-dimethyl-pyrazole-3-carboxamide Formula: C17H16N4O2S MolecularWeight: 340.39954

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN(N=C1C(=O)N=C2N(C3=C(S2)C=C(C=C3)OC)CC#C)C

Isomeric SMILES

CC1=CN(N=C1C(=O)N=C2N(C3=C(S2)C=C(C=C3)OC)CC#C)C

InChI

InChI=1S/C17H16N4O2S/c1-5-8-21-13-7-6-12(23-4)9-14(13)24-17(21)18-16(22)15-11(2)10-20(3)19-15/h1,6-7,9-10H,8H2,2-4H3