N-[1,1-bis(oxidanylidene)thiolan-3-yl]-1-[3-(4-methoxyphenyl)-1-phenyl-pyrazol-4-yl]methanimine

Systemtic Name: N-[1,1-bis(oxidanylidene)thiolan-3-yl]-1-[3-(4-methoxyphenyl)-1-phenyl-pyrazol-4-yl]methanimine Openeye Name: N-(1,1-dioxothiolan-3-yl)-1-[3-(4-methoxyphenyl)-1-phenyl-pyrazol-4-yl]methanimine CAS Name: N-(1,1-dioxo-3-thiolanyl)-1-[3-(4-methoxyphenyl)-1-phenyl-4-pyrazolyl]methanimine IUPAC Name: N-(1,1-dioxothiolan-3-yl)-1-[3-(4-methoxyphenyl)-1-phenylpyrazol-4-yl]methanimine Traditional Name: (1,1-diketothiolan-3-yl)-[[3-(4-methoxyphenyl)-1-phenyl-pyrazol-4-yl]methylene]amine Formula: C21H21N3O3S MolecularWeight: 395.47474

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NN(C=C2C=NC3CCS(=O)(=O)C3)C4=CC=CC=C4

Isomeric SMILES

COC1=CC=C(C=C1)C2=NN(C=C2C=NC3CCS(=O)(=O)C3)C4=CC=CC=C4

InChI

InChI=1S/C21H21N3O3S/c1-27-20-9-7-16(8-10-20)21-17(13-22-18-11-12-28(25,26)15-18)14-24(23-21)19-5-3-2-4-6-19/h2-10,13-14,18H,11-12,15H2,1H3