ethyl 1-[[4-[2-[(E)-dimethylaminomethylideneamino]sulfonylphenyl]phenyl]methyl]-2-ethyl-5-methylsulfanyl-imidazole-4-carboxylate

Systemtic Name: ethyl 1-[[4-[2-[(E)-dimethylaminomethylideneamino]sulfonylphenyl]phenyl]methyl]-2-ethyl-5-methylsulfanyl-imidazole-4-carboxylate Openeye Name: ethyl 1-[[4-[2-[(E)-dimethylaminomethyleneamino]sulfonylphenyl]phenyl]methyl]-2-ethyl-5-methylsulfanyl-imidazole-4-carboxylate CAS Name: 1-[[4-[2-[(E)-dimethylaminomethylideneamino]sulfonylphenyl]phenyl]methyl]-2-ethyl-5-(methylthio)-4-imidazolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[[4-[2-[(E)-dimethylaminomethylideneamino]sulfonylphenyl]phenyl]methyl]-2-ethyl-5-methylsulfanylimidazole-4-carboxylate Traditional Name: 1-[4-[2-[(E)-dimethylaminomethyleneamino]sulfonylphenyl]benzyl]-2-ethyl-5-(methylthio)imidazole-4-carboxylic acid ethyl ester Formula: C25H30N4O4S2 MolecularWeight: 514.6601

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC(=C(N1CC2=CC=C(C=C2)C3=CC=CC=C3S(=O)(=O)N=CN(C)C)SC)C(=O)OCC

Isomeric SMILES

CCC1=NC(=C(N1CC2=CC=C(C=C2)C3=CC=CC=C3S(=O)(=O)/N=C/N(C)C)SC)C(=O)OCC

InChI

InChI=1S/C25H30N4O4S2/c1-6-22-27-23(25(30)33-7-2)24(34-5)29(22)16-18-12-14-19(15-13-18)20-10-8-9-11-21(20)35(31,32)26-17-28(3)4/h8-15,17H,6-7,16H2,1-5H3/b26-17+