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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NN(C(=O)C1=C(C)NC2=CC=C(C=C2)C(=O)OCC)C3=NC4=CC=CC=C4S3

Isomeric SMILES

CCCC1=NN(C(=O)C1=C(C)NC2=CC=C(C=C2)C(=O)OCC)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/h6-7,9-14,25H,4-5,8H2,1-3H3