N-[4-[(2E)-2-(1-carbamothioyl-3-methylidene-5-oxidanylidene-pyrazolidin-4-ylidene)hydrazinyl]phenyl]ethanamide

Systemtic Name: N-[4-[(2E)-2-(1-carbamothioyl-3-methylidene-5-oxidanylidene-pyrazolidin-4-ylidene)hydrazinyl]phenyl]ethanamide Openeye Name: N-[4-[(2E)-2-(1-carbamothioyl-3-methylene-5-oxo-pyrazolidin-4-ylidene)hydrazino]phenyl]acetamide CAS Name: N-[4-[(2E)-2-(1-carbamothioyl-3-methylene-5-oxo-4-pyrazolidinylidene)hydrazinyl]phenyl]acetamide IUPAC Name: N-[4-[(2E)-2-(1-carbamothioyl-3-methylidene-5-oxopyrazolidin-4-ylidene)hydrazinyl]phenyl]acetamide Traditional Name: N-[4-[(N'E)-N'-(5-keto-3-methylene-1-thiocarbamoyl-pyrazolidin-4-ylidene)hydrazino]phenyl]acetamide Formula: C13H14N6O2S MolecularWeight: 318.35426

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)NN=C2C(=C)NN(C2=O)C(=S)N

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)N/N=C/2\C(=C)NN(C2=O)C(=S)N

InChI

InChI=1S/C13H14N6O2S/c1-7-11(12(21)19(18-7)13(14)22)17-16-10-5-3-9(4-6-10)15-8(2)20/h3-6,16,18H,1H2,2H3,(H2,14,22)(H,15,20)/b17-11+