N-(6-chloranyl-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-2-ethyl-pyrazole-3-carboxamide

Systemtic Name: N-(6-chloranyl-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-2-ethyl-pyrazole-3-carboxamide Openeye Name: N-(6-chloro-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-2-ethyl-pyrazole-3-carboxamide CAS Name: N-(6-chloro-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-2-ethyl-3-pyrazolecarboxamide IUPAC Name: N-(6-chloro-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-2-ethylpyrazole-3-carboxamide Traditional Name: N-(6-chloro-3-propargyl-1,3-benzothiazol-2-ylidene)-2-ethyl-pyrazole-3-carboxamide Formula: C16H13ClN4OS MolecularWeight: 344.81862

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=CC=N1)C(=O)N=C2N(C3=C(S2)C=C(C=C3)Cl)CC#C

Isomeric SMILES

CCN1C(=CC=N1)C(=O)N=C2N(C3=C(S2)C=C(C=C3)Cl)CC#C

InChI

InChI=1S/C16H13ClN4OS/c1-3-9-20-12-6-5-11(17)10-14(12)23-16(20)19-15(22)13-7-8-18-21(13)4-2/h1,5-8,10H,4,9H2,2H3