diethyl 5-[2-[3-(4-chloranylbutanoylamino)-5-oxidanylidene-1-phenyl-pyrazol-4-ylidene]hydrazinyl]-3-methyl-thiophene-2,4-dicarboxylate

Systemtic Name: diethyl 5-[2-[3-(4-chloranylbutanoylamino)-5-oxidanylidene-1-phenyl-pyrazol-4-ylidene]hydrazinyl]-3-methyl-thiophene-2,4-dicarboxylate Openeye Name: diethyl 5-[2-[3-(4-chlorobutanoylamino)-5-oxo-1-phenyl-pyrazol-4-ylidene]hydrazino]-3-methyl-thiophene-2,4-dicarboxylate CAS Name: 5-[2-[3-[(4-chloro-1-oxobutyl)amino]-5-oxo-1-phenyl-4-pyrazolylidene]hydrazinyl]-3-methylthiophene-2,4-dicarboxylic acid diethyl ester IUPAC Name: diethyl 5-[2-[3-(4-chlorobutanoylamino)-5-oxo-1-phenylpyrazol-4-ylidene]hydrazinyl]-3-methylthiophene-2,4-dicarboxylate Traditional Name: 5-[N'-[3-(4-chlorobutanoylamino)-5-keto-1-phenyl-2-pyrazolin-4-ylidene]hydrazino]-3-methyl-thiophene-2,4-dicarboxylic acid diethyl ester Formula: C24H26ClN5O6S MolecularWeight: 548.01114

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C(=O)OCC)NN=C2C(=NN(C2=O)C3=CC=CC=C3)NC(=O)CCCCl

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C(=O)OCC)NN=C2C(=NN(C2=O)C3=CC=CC=C3)NC(=O)CCCCl

InChI

InChI=1S/C24H26ClN5O6S/c1-4-35-23(33)17-14(3)19(24(34)36-5-2)37-21(17)28-27-18-20(26-16(31)12-9-13-25)29-30(22(18)32)15-10-7-6-8-11-15/h6-8,10-11,28H,4-5,9,12-13H2,1-3H3,(H,26,29,31)