N-[2-[(3,5-dimethyl-1H-pyrazol-4-yl)sulfanyl]phenyl]-1-(5-nitrofuran-2-yl)methanimine

Systemtic Name: N-[2-[(3,5-dimethyl-1H-pyrazol-4-yl)sulfanyl]phenyl]-1-(5-nitrofuran-2-yl)methanimine Openeye Name: N-[2-[(3,5-dimethyl-1H-pyrazol-4-yl)sulfanyl]phenyl]-1-(5-nitro-2-furyl)methanimine CAS Name: N-[2-[(3,5-dimethyl-1H-pyrazol-4-yl)thio]phenyl]-1-(5-nitro-2-furanyl)methanimine IUPAC Name: N-[2-[(3,5-dimethyl-1H-pyrazol-4-yl)sulfanyl]phenyl]-1-(5-nitrofuran-2-yl)methanimine Traditional Name: [2-[(3,5-dimethyl-1H-pyrazol-4-yl)thio]phenyl]-[(5-nitro-2-furyl)methylene]amine Formula: C16H14N4O3S MolecularWeight: 342.37236

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1)C)SC2=CC=CC=C2N=CC3=CC=C(O3)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1)C)SC2=CC=CC=C2N=CC3=CC=C(O3)[N+](=O)[O-]

InChI

InChI=1S/C16H14N4O3S/c1-10-16(11(2)19-18-10)24-14-6-4-3-5-13(14)17-9-12-7-8-15(23-12)20(21)22/h3-9H,1-2H3,(H,18,19)