ethyl 5-[1-[1-(1,3-benzothiazol-2-yl)-3-methylidene-5-oxidanylidene-pyrazolidin-4-ylidene]ethylamino]-1H-pyrazole-4-carboxylate

Systemtic Name: ethyl 5-[1-[1-(1,3-benzothiazol-2-yl)-3-methylidene-5-oxidanylidene-pyrazolidin-4-ylidene]ethylamino]-1H-pyrazole-4-carboxylate Openeye Name: ethyl 5-[1-[1-(1,3-benzothiazol-2-yl)-3-methylene-5-oxo-pyrazolidin-4-ylidene]ethylamino]-1H-pyrazole-4-carboxylate CAS Name: 5-[1-[1-(1,3-benzothiazol-2-yl)-3-methylene-5-oxo-4-pyrazolidinylidene]ethylamino]-1H-pyrazole-4-carboxylic acid ethyl ester IUPAC Name: ethyl 5-[1-[1-(1,3-benzothiazol-2-yl)-3-methylidene-5-oxopyrazolidin-4-ylidene]ethylamino]-1H-pyrazole-4-carboxylate Traditional Name: 5-[1-[1-(1,3-benzothiazol-2-yl)-5-keto-3-methylene-pyrazolidin-4-ylidene]ethylamino]-1H-pyrazole-4-carboxylic acid ethyl ester Formula: C19H18N6O3S MolecularWeight: 410.44962

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NN=C1)NC(=C2C(=C)NN(C2=O)C3=NC4=CC=CC=C4S3)C

Isomeric SMILES

CCOC(=O)C1=C(NN=C1)NC(=C2C(=C)NN(C2=O)C3=NC4=CC=CC=C4S3)C

InChI

InChI=1S/C19H18N6O3S/c1-4-28-18(27)12-9-20-23-16(12)21-10(2)15-11(3)24-25(17(15)26)19-22-13-7-5-6-8-14(13)29-19/h5-9,24H,3-4H2,1-2H3,(H2,20,21,23)