ethyl 4-[1-[1-(1,3-benzothiazol-2-yl)-5-oxidanylidene-3-propyl-4H-pyrazol-4-yl]ethylideneamino]benzoate

Systemtic Name: ethyl 4-[1-[1-(1,3-benzothiazol-2-yl)-5-oxidanylidene-3-propyl-4H-pyrazol-4-yl]ethylideneamino]benzoate Openeye Name: ethyl 4-[1-[1-(1,3-benzothiazol-2-yl)-5-oxo-3-propyl-4H-pyrazol-4-yl]ethylideneamino]benzoate CAS Name: 4-[1-[1-(1,3-benzothiazol-2-yl)-5-oxo-3-propyl-4H-pyrazol-4-yl]ethylideneamino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[1-[1-(1,3-benzothiazol-2-yl)-5-oxo-3-propyl-4H-pyrazol-4-yl]ethylideneamino]benzoate Traditional Name: 4-[1-[1-(1,3-benzothiazol-2-yl)-5-keto-3-propyl-2-pyrazolin-4-yl]ethylideneamino]benzoic acid ethyl ester Formula: C24H24N4O3S MolecularWeight: 448.53736

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NN(C(=O)C1C(=NC2=CC=C(C=C2)C(=O)OCC)C)C3=NC4=CC=CC=C4S3

Isomeric SMILES

CCCC1=NN(C(=O)C1C(=NC2=CC=C(C=C2)C(=O)OCC)C)C3=NC4=CC=CC=C4S3

InChI

InChI=1S/C24H24N4O3S/c1-4-8-19-21(15(3)25-17-13-11-16(12-14-17)23(30)31-5-2)22(29)28(27-19)24-26-18-9-6-7-10-20(18)32-24/h6-7,9-14,21H,4-5,8H2,1-3H3