ethyl 2-[2-(1-methylimidazol-2-yl)sulfanylethanoylamino]-4-phenyl-1,3-thiazole-5-carboxylate

Systemtic Name: ethyl 2-[2-(1-methylimidazol-2-yl)sulfanylethanoylamino]-4-phenyl-1,3-thiazole-5-carboxylate Openeye Name: ethyl 2-[[2-(1-methylimidazol-2-yl)sulfanylacetyl]amino]-4-phenyl-thiazole-5-carboxylate CAS Name: 2-[[2-[(1-methyl-2-imidazolyl)thio]-1-oxoethyl]amino]-4-phenyl-5-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[2-(1-methylimidazol-2-yl)sulfanylacetyl]amino]-4-phenyl-1,3-thiazole-5-carboxylate Traditional Name: 2-[[2-[(1-methylimidazol-2-yl)thio]acetyl]amino]-4-phenyl-thiazole-5-carboxylic acid ethyl ester Formula: C18H18N4O3S2 MolecularWeight: 402.49052

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=C(S1)NC(=O)CSC2=NC=CN2C)C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1=C(N=C(S1)NC(=O)CSC2=NC=CN2C)C3=CC=CC=C3

InChI

InChI=1S/C18H18N4O3S2/c1-3-25-16(24)15-14(12-7-5-4-6-8-12)21-17(27-15)20-13(23)11-26-18-19-9-10-22(18)2/h4-10H,3,11H2,1-2H3,(H,20,21,23)