N-[5-chloranyl-3-[2-(4-isocyano-5-methyl-2-phenyl-pyrazol-3-yl)hydrazinyl]-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene]propanamide

Systemtic Name: N-[5-chloranyl-3-[2-(4-isocyano-5-methyl-2-phenyl-pyrazol-3-yl)hydrazinyl]-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene]propanamide Openeye Name: N-[5-chloro-3-[2-(4-isocyano-5-methyl-2-phenyl-pyrazol-3-yl)hydrazino]-6-oxo-cyclohexa-2,4-dien-1-ylidene]propanamide CAS Name: N-[5-chloro-3-[(4-isocyano-5-methyl-2-phenyl-3-pyrazolyl)hydrazo]-6-oxo-1-cyclohexa-2,4-dienylidene]propanamide IUPAC Name: N-[5-chloro-3-[2-(4-isocyano-5-methyl-2-phenylpyrazol-3-yl)hydrazinyl]-6-oxocyclohexa-2,4-dien-1-ylidene]propanamide Traditional Name: N-[5-chloro-3-[N'-(4-isocyano-5-methyl-2-phenyl-pyrazol-3-yl)hydrazino]-6-keto-cyclohexa-2,4-dien-1-ylidene]propionamide Formula: C20H17ClN6O2 MolecularWeight: 408.84098

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N=C1C=C(C=C(C1=O)Cl)NNC2=C(C(=NN2C3=CC=CC=C3)C)[N+]#[C-]

Isomeric SMILES

CCC(=O)N=C1C=C(C=C(C1=O)Cl)NNC2=C(C(=NN2C3=CC=CC=C3)C)[N+]#[C-]

InChI

InChI=1S/C20H17ClN6O2/c1-4-17(28)23-16-11-13(10-15(21)19(16)29)24-25-20-18(22-3)12(2)26-27(20)14-8-6-5-7-9-14/h5-11,24-25H,4H2,1-2H3