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

Systemtic Name: ethyl 4-methyl-2-[2-(1-phenylbenzimidazol-2-yl)sulfanylethanoylamino]-1,3-thiazole-5-carboxylate Openeye Name: ethyl 4-methyl-2-[[2-(1-phenylbenzimidazol-2-yl)sulfanylacetyl]amino]thiazole-5-carboxylate CAS Name: 4-methyl-2-[[1-oxo-2-[(1-phenyl-2-benzimidazolyl)thio]ethyl]amino]-5-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 4-methyl-2-[[2-(1-phenylbenzimidazol-2-yl)sulfanylacetyl]amino]-1,3-thiazole-5-carboxylate Traditional Name: 4-methyl-2-[[2-[(1-phenylbenzimidazol-2-yl)thio]acetyl]amino]thiazole-5-carboxylic acid ethyl ester Formula: C22H20N4O3S2 MolecularWeight: 452.5492

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=C(S1)NC(=O)CSC2=NC3=CC=CC=C3N2C4=CC=CC=C4)C

Isomeric SMILES

CCOC(=O)C1=C(N=C(S1)NC(=O)CSC2=NC3=CC=CC=C3N2C4=CC=CC=C4)C

InChI

InChI=1S/C22H20N4O3S2/c1-3-29-20(28)19-14(2)23-21(31-19)25-18(27)13-30-22-24-16-11-7-8-12-17(16)26(22)15-9-5-4-6-10-15/h4-12H,3,13H2,1-2H3,(H,23,25,27)