N'-[(1E)-1-[1-(1,3-benzothiazol-2-yl)-5-oxidanylidene-3-propyl-pyrazol-4-ylidene]ethyl]-3-methyl-butanehydrazide

Systemtic Name: N'-[(1E)-1-[1-(1,3-benzothiazol-2-yl)-5-oxidanylidene-3-propyl-pyrazol-4-ylidene]ethyl]-3-methyl-butanehydrazide Openeye Name: N'-[(1E)-1-[1-(1,3-benzothiazol-2-yl)-5-oxo-3-propyl-pyrazol-4-ylidene]ethyl]-3-methyl-butanehydrazide CAS Name: N'-[(1E)-1-[1-(1,3-benzothiazol-2-yl)-5-oxo-3-propyl-4-pyrazolylidene]ethyl]-3-methylbutanehydrazide IUPAC Name: N'-[(1E)-1-[1-(1,3-benzothiazol-2-yl)-5-oxo-3-propylpyrazol-4-ylidene]ethyl]-3-methylbutanehydrazide Traditional Name: N'-[(1E)-1-[1-(1,3-benzothiazol-2-yl)-5-keto-3-propyl-2-pyrazolin-4-ylidene]ethyl]-3-methyl-butyrohydrazide Formula: C20H25N5O2S MolecularWeight: 399.5098

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NN(C(=O)C1=C(C)NNC(=O)CC(C)C)C2=NC3=CC=CC=C3S2

Isomeric SMILES

CCCC\1=NN(C(=O)/C1=C(\C)/NNC(=O)CC(C)C)C2=NC3=CC=CC=C3S2

InChI

InChI=1S/C20H25N5O2S/c1-5-8-15-18(13(4)22-23-17(26)11-12(2)3)19(27)25(24-15)20-21-14-9-6-7-10-16(14)28-20/h6-7,9-10,12,22H,5,8,11H2,1-4H3,(H,23,26)/b18-13+