ethyl 2-[2-[6-(4-ethylphenyl)pyridazin-3-yl]sulfanylethanoylamino]-4-methyl-1,3-thiazole-5-carboxylate

Systemtic Name: ethyl 2-[2-[6-(4-ethylphenyl)pyridazin-3-yl]sulfanylethanoylamino]-4-methyl-1,3-thiazole-5-carboxylate Openeye Name: ethyl 2-[[2-[6-(4-ethylphenyl)pyridazin-3-yl]sulfanylacetyl]amino]-4-methyl-thiazole-5-carboxylate CAS Name: 2-[[2-[[6-(4-ethylphenyl)-3-pyridazinyl]thio]-1-oxoethyl]amino]-4-methyl-5-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[2-[6-(4-ethylphenyl)pyridazin-3-yl]sulfanylacetyl]amino]-4-methyl-1,3-thiazole-5-carboxylate Traditional Name: 2-[[2-[[6-(4-ethylphenyl)pyridazin-3-yl]thio]acetyl]amino]-4-methyl-thiazole-5-carboxylic acid ethyl ester Formula: C21H22N4O3S2 MolecularWeight: 442.55438

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2=NN=C(C=C2)SCC(=O)NC3=NC(=C(S3)C(=O)OCC)C

Isomeric SMILES

CCC1=CC=C(C=C1)C2=NN=C(C=C2)SCC(=O)NC3=NC(=C(S3)C(=O)OCC)C

InChI

InChI=1S/C21H22N4O3S2/c1-4-14-6-8-15(9-7-14)16-10-11-18(25-24-16)29-12-17(26)23-21-22-13(3)19(30-21)20(27)28-5-2/h6-11H,4-5,12H2,1-3H3,(H,22,23,26)