S-[5-(4-methylphenyl)sulfonyl-2-phenyl-1H-imidazol-4-yl] benzenecarbothioate

Systemtic Name: S-[5-(4-methylphenyl)sulfonyl-2-phenyl-1H-imidazol-4-yl] benzenecarbothioate Openeye Name: S-[2-phenyl-5-(p-tolylsulfonyl)-1H-imidazol-4-yl] benzenecarbothioate CAS Name: benzenecarbothioic acid S-[5-(4-methylphenyl)sulfonyl-2-phenyl-1H-imidazol-4-yl] ester IUPAC Name: S-[5-(4-methylphenyl)sulfonyl-2-phenyl-1H-imidazol-4-yl] benzenecarbothioate Traditional Name: thiobenzoic acid S-(2-phenyl-5-tosyl-1H-imidazol-4-yl) ester Formula: C23H18N2O3S2 MolecularWeight: 434.53062

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)C2=C(N=C(N2)C3=CC=CC=C3)SC(=O)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)C2=C(N=C(N2)C3=CC=CC=C3)SC(=O)C4=CC=CC=C4

InChI

InChI=1S/C23H18N2O3S2/c1-16-12-14-19(15-13-16)30(27,28)22-21(29-23(26)18-10-6-3-7-11-18)24-20(25-22)17-8-4-2-5-9-17/h2-15H,1H3,(H,24,25)