ethyl 2-[2-(1-azanyl-4-phenyl-imidazol-2-yl)sulfanylethanoylamino]-5-(dimethylcarbamoyl)-4-methyl-thiophene-3-carboxylate

Systemtic Name: ethyl 2-[2-(1-azanyl-4-phenyl-imidazol-2-yl)sulfanylethanoylamino]-5-(dimethylcarbamoyl)-4-methyl-thiophene-3-carboxylate Openeye Name: ethyl 2-[[2-(1-amino-4-phenyl-imidazol-2-yl)sulfanylacetyl]amino]-5-(dimethylcarbamoyl)-4-methyl-thiophene-3-carboxylate CAS Name: 2-[[2-[(1-amino-4-phenyl-2-imidazolyl)thio]-1-oxoethyl]amino]-5-[dimethylamino(oxo)methyl]-4-methyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[2-(1-amino-4-phenylimidazol-2-yl)sulfanylacetyl]amino]-5-(dimethylcarbamoyl)-4-methylthiophene-3-carboxylate Traditional Name: 2-[[2-[(1-amino-4-phenyl-imidazol-2-yl)thio]acetyl]amino]-5-(dimethylcarbamoyl)-4-methyl-thiophene-3-carboxylic acid ethyl ester Formula: C22H25N5O4S2 MolecularWeight: 487.595

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C(=O)N(C)C)NC(=O)CSC2=NC(=CN2N)C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C(=O)N(C)C)NC(=O)CSC2=NC(=CN2N)C3=CC=CC=C3

InChI

InChI=1S/C22H25N5O4S2/c1-5-31-21(30)17-13(2)18(20(29)26(3)4)33-19(17)25-16(28)12-32-22-24-15(11-27(22)23)14-9-7-6-8-10-14/h6-11H,5,12,23H2,1-4H3,(H,25,28)