N'-[(1Z)-1-[1-(1,3-benzothiazol-2-yl)-5-oxidanylidene-3-propyl-pyrazol-4-ylidene]ethyl]pyridine-3-carbohydrazide

Systemtic Name: N'-[(1Z)-1-[1-(1,3-benzothiazol-2-yl)-5-oxidanylidene-3-propyl-pyrazol-4-ylidene]ethyl]pyridine-3-carbohydrazide Openeye Name: N'-[(1Z)-1-[1-(1,3-benzothiazol-2-yl)-5-oxo-3-propyl-pyrazol-4-ylidene]ethyl]pyridine-3-carbohydrazide CAS Name: N'-[(1Z)-1-[1-(1,3-benzothiazol-2-yl)-5-oxo-3-propyl-4-pyrazolylidene]ethyl]-3-pyridinecarbohydrazide IUPAC Name: N'-[(1Z)-1-[1-(1,3-benzothiazol-2-yl)-5-oxo-3-propylpyrazol-4-ylidene]ethyl]pyridine-3-carbohydrazide Traditional Name: N'-[(1Z)-1-[1-(1,3-benzothiazol-2-yl)-5-keto-3-propyl-2-pyrazolin-4-ylidene]ethyl]nicotinohydrazide Formula: C21H20N6O2S MolecularWeight: 420.4875

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NN(C(=O)C1=C(C)NNC(=O)C2=CN=CC=C2)C3=NC4=CC=CC=C4S3

Isomeric SMILES

CCCC\1=NN(C(=O)/C1=C(/C)\NNC(=O)C2=CN=CC=C2)C3=NC4=CC=CC=C4S3

InChI

InChI=1S/C21H20N6O2S/c1-3-7-16-18(13(2)24-25-19(28)14-8-6-11-22-12-14)20(29)27(26-16)21-23-15-9-4-5-10-17(15)30-21/h4-6,8-12,24H,3,7H2,1-2H3,(H,25,28)/b18-13-