2-[3,5-dimethyl-4-[2-[(4-nitrophenyl)methylideneamino]phenyl]sulfanyl-pyrazol-1-yl]ethanol

Systemtic Name: 2-[3,5-dimethyl-4-[2-[(4-nitrophenyl)methylideneamino]phenyl]sulfanyl-pyrazol-1-yl]ethanol Openeye Name: 2-[3,5-dimethyl-4-[2-[(4-nitrophenyl)methyleneamino]phenyl]sulfanyl-pyrazol-1-yl]ethanol CAS Name: 2-[3,5-dimethyl-4-[[2-[(4-nitrophenyl)methylideneamino]phenyl]thio]-1-pyrazolyl]ethanol IUPAC Name: 2-[3,5-dimethyl-4-[2-[(4-nitrophenyl)methylideneamino]phenyl]sulfanylpyrazol-1-yl]ethanol Traditional Name: 2-[3,5-dimethyl-4-[[2-[(4-nitrobenzylidene)amino]phenyl]thio]pyrazol-1-yl]ethanol Formula: C20H20N4O3S MolecularWeight: 396.4628

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CCO)C)SC2=CC=CC=C2N=CC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1CCO)C)SC2=CC=CC=C2N=CC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H20N4O3S/c1-14-20(15(2)23(22-14)11-12-25)28-19-6-4-3-5-18(19)21-13-16-7-9-17(10-8-16)24(26)27/h3-10,13,25H,11-12H2,1-2H3