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

Systemtic Name: N'-[(1E)-1-[1-(1,3-benzothiazol-2-yl)-3-methyl-5-oxidanylidene-pyrazol-4-ylidene]ethyl]-3-methyl-butanehydrazide Openeye Name: N'-[(1E)-1-[1-(1,3-benzothiazol-2-yl)-3-methyl-5-oxo-pyrazol-4-ylidene]ethyl]-3-methyl-butanehydrazide CAS Name: N'-[(1E)-1-[1-(1,3-benzothiazol-2-yl)-3-methyl-5-oxo-4-pyrazolylidene]ethyl]-3-methylbutanehydrazide IUPAC Name: N'-[(1E)-1-[1-(1,3-benzothiazol-2-yl)-3-methyl-5-oxopyrazol-4-ylidene]ethyl]-3-methylbutanehydrazide Traditional Name: N'-[(1E)-1-[1-(1,3-benzothiazol-2-yl)-5-keto-3-methyl-2-pyrazolin-4-ylidene]ethyl]-3-methyl-butyrohydrazide Formula: C18H21N5O2S MolecularWeight: 371.45664

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C1=C(C)NNC(=O)CC(C)C)C2=NC3=CC=CC=C3S2

Isomeric SMILES

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

InChI

InChI=1S/C18H21N5O2S/c1-10(2)9-15(24)21-20-11(3)16-12(4)22-23(17(16)25)18-19-13-7-5-6-8-14(13)26-18/h5-8,10,20H,9H2,1-4H3,(H,21,24)/b16-11+