methyl 2-[2-(3-cyclohexylimidazo[4,5-b]pyridin-2-yl)sulfanylethanoylamino]-4-methyl-1,3-thiazole-5-carboxylate

Systemtic Name: methyl 2-[2-(3-cyclohexylimidazo[4,5-b]pyridin-2-yl)sulfanylethanoylamino]-4-methyl-1,3-thiazole-5-carboxylate Openeye Name: methyl 2-[[2-(3-cyclohexylimidazo[4,5-b]pyridin-2-yl)sulfanylacetyl]amino]-4-methyl-thiazole-5-carboxylate CAS Name: 2-[[2-[(3-cyclohexyl-2-imidazo[4,5-b]pyridinyl)thio]-1-oxoethyl]amino]-4-methyl-5-thiazolecarboxylic acid methyl ester IUPAC Name: methyl 2-[[2-(3-cyclohexylimidazo[4,5-b]pyridin-2-yl)sulfanylacetyl]amino]-4-methyl-1,3-thiazole-5-carboxylate Traditional Name: 2-[[2-[(3-cyclohexylimidazo[4,5-b]pyridin-2-yl)thio]acetyl]amino]-4-methyl-thiazole-5-carboxylic acid methyl ester Formula: C20H23N5O3S2 MolecularWeight: 445.55832

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)NC(=O)CSC2=NC3=C(N2C4CCCCC4)N=CC=C3)C(=O)OC

Isomeric SMILES

CC1=C(SC(=N1)NC(=O)CSC2=NC3=C(N2C4CCCCC4)N=CC=C3)C(=O)OC

InChI

InChI=1S/C20H23N5O3S2/c1-12-16(18(27)28-2)30-19(22-12)24-15(26)11-29-20-23-14-9-6-10-21-17(14)25(20)13-7-4-3-5-8-13/h6,9-10,13H,3-5,7-8,11H2,1-2H3,(H,22,24,26)