ethyl 4-methyl-2-[pentyl-[4-(thiophen-2-ylcarbonylamino)butanoyl]amino]-1,3-thiazole-5-carboxylate

Systemtic Name: ethyl 4-methyl-2-[pentyl-[4-(thiophen-2-ylcarbonylamino)butanoyl]amino]-1,3-thiazole-5-carboxylate Openeye Name: ethyl 4-methyl-2-[pentyl-[4-(thiophene-2-carbonylamino)butanoyl]amino]thiazole-5-carboxylate CAS Name: 4-methyl-2-[[1-oxo-4-[[oxo(thiophen-2-yl)methyl]amino]butyl]-pentylamino]-5-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 4-methyl-2-[pentyl-[4-(thiophene-2-carbonylamino)butanoyl]amino]-1,3-thiazole-5-carboxylate Traditional Name: 2-[amyl-[4-(2-thenoylamino)butanoyl]amino]-4-methyl-thiazole-5-carboxylic acid ethyl ester Formula: C21H29N3O4S2 MolecularWeight: 451.60266

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN(C1=NC(=C(S1)C(=O)OCC)C)C(=O)CCCNC(=O)C2=CC=CS2

Isomeric SMILES

CCCCCN(C1=NC(=C(S1)C(=O)OCC)C)C(=O)CCCNC(=O)C2=CC=CS2

InChI

InChI=1S/C21H29N3O4S2/c1-4-6-7-13-24(21-23-15(3)18(30-21)20(27)28-5-2)17(25)11-8-12-22-19(26)16-10-9-14-29-16/h9-10,14H,4-8,11-13H2,1-3H3,(H,22,26)