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

Systemtic Name: ethyl 1-[[4-[2-[(E)-dimethylaminomethylideneamino]sulfonylphenyl]phenyl]methyl]-5-methylsulfanyl-2-propyl-imidazole-4-carboxylate Openeye Name: ethyl 1-[[4-[2-[(E)-dimethylaminomethyleneamino]sulfonylphenyl]phenyl]methyl]-5-methylsulfanyl-2-propyl-imidazole-4-carboxylate CAS Name: 1-[[4-[2-[(E)-dimethylaminomethylideneamino]sulfonylphenyl]phenyl]methyl]-5-(methylthio)-2-propyl-4-imidazolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[[4-[2-[(E)-dimethylaminomethylideneamino]sulfonylphenyl]phenyl]methyl]-5-methylsulfanyl-2-propylimidazole-4-carboxylate Traditional Name: 1-[4-[2-[(E)-dimethylaminomethyleneamino]sulfonylphenyl]benzyl]-5-(methylthio)-2-propyl-imidazole-4-carboxylic acid ethyl ester Formula: C26H32N4O4S2 MolecularWeight: 528.68668

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NC(=C(N1CC2=CC=C(C=C2)C3=CC=CC=C3S(=O)(=O)N=CN(C)C)SC)C(=O)OCC

Isomeric SMILES

CCCC1=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/C26H32N4O4S2/c1-6-10-23-28-24(26(31)34-7-2)25(35-5)30(23)17-19-13-15-20(16-14-19)21-11-8-9-12-22(21)36(32,33)27-18-29(3)4/h8-9,11-16,18H,6-7,10,17H2,1-5H3/b27-18+