N-[4-[(2Z)-2-[1-carbamothioyl-3-(4-nitrophenyl)-5-oxidanylidene-pyrazol-4-ylidene]hydrazinyl]phenyl]-N-methyl-ethanamide

Systemtic Name: N-[4-[(2Z)-2-[1-carbamothioyl-3-(4-nitrophenyl)-5-oxidanylidene-pyrazol-4-ylidene]hydrazinyl]phenyl]-N-methyl-ethanamide Openeye Name: N-[4-[(2Z)-2-[1-carbamothioyl-3-(4-nitrophenyl)-5-oxo-pyrazol-4-ylidene]hydrazino]phenyl]-N-methyl-acetamide CAS Name: N-[4-[(2Z)-2-[1-carbamothioyl-3-(4-nitrophenyl)-5-oxo-4-pyrazolylidene]hydrazinyl]phenyl]-N-methylacetamide IUPAC Name: N-[4-[(2Z)-2-[1-carbamothioyl-3-(4-nitrophenyl)-5-oxopyrazol-4-ylidene]hydrazinyl]phenyl]-N-methylacetamide Traditional Name: N-[4-[(N'Z)-N'-[5-keto-3-(4-nitrophenyl)-1-thiocarbamoyl-2-pyrazolin-4-ylidene]hydrazino]phenyl]-N-methyl-acetamide Formula: C19H17N7O4S MolecularWeight: 439.44778

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N(C)C1=CC=C(C=C1)NN=C2C(=NN(C2=O)C(=S)N)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC(=O)N(C)C1=CC=C(C=C1)N/N=C\2/C(=NN(C2=O)C(=S)N)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C19H17N7O4S/c1-11(27)24(2)14-9-5-13(6-10-14)21-22-17-16(23-25(18(17)28)19(20)31)12-3-7-15(8-4-12)26(29)30/h3-10,21H,1-2H3,(H2,20,31)/b22-17-