methyl 3-[(3,4-dichlorophenyl)methyl]-5-(2,2-dimethoxyethylcarbamoylamino)-2-sulfanylidene-1H-imidazole-4-carboxylate

Systemtic Name: methyl 3-[(3,4-dichlorophenyl)methyl]-5-(2,2-dimethoxyethylcarbamoylamino)-2-sulfanylidene-1H-imidazole-4-carboxylate Openeye Name: methyl 3-[(3,4-dichlorophenyl)methyl]-5-(2,2-dimethoxyethylcarbamoylamino)-2-thioxo-1H-imidazole-4-carboxylate CAS Name: 3-[(3,4-dichlorophenyl)methyl]-5-[[(2,2-dimethoxyethylamino)-oxomethyl]amino]-2-sulfanylidene-1H-imidazole-4-carboxylic acid methyl ester IUPAC Name: methyl 3-[(3,4-dichlorophenyl)methyl]-5-(2,2-dimethoxyethylcarbamoylamino)-2-sulfanylidene-1H-imidazole-4-carboxylate Traditional Name: 3-(3,4-dichlorobenzyl)-5-(2,2-dimethoxyethylcarbamoylamino)-2-thioxo-4-imidazoline-4-carboxylic acid methyl ester Formula: C17H20Cl2N4O5S MolecularWeight: 463.3355

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Descriptors Computed from Structure

Canonical SMILES:

COC(CNC(=O)NC1=C(N(C(=S)N1)CC2=CC(=C(C=C2)Cl)Cl)C(=O)OC)OC

Isomeric SMILES

COC(CNC(=O)NC1=C(N(C(=S)N1)CC2=CC(=C(C=C2)Cl)Cl)C(=O)OC)OC

InChI

InChI=1S/C17H20Cl2N4O5S/c1-26-12(27-2)7-20-16(25)21-14-13(15(24)28-3)23(17(29)22-14)8-9-4-5-10(18)11(19)6-9/h4-6,12H,7-8H2,1-3H3,(H,22,29)(H2,20,21,25)