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

Systemtic Name: ethyl 4-methyl-2-[pentyl-[4-(thiophen-3-ylcarbonylamino)butanoyl]amino]-1,3-thiazole-5-carboxylate Openeye Name: ethyl 4-methyl-2-[pentyl-[4-(thiophene-3-carbonylamino)butanoyl]amino]thiazole-5-carboxylate CAS Name: 4-methyl-2-[[1-oxo-4-[[oxo(3-thiophenyl)methyl]amino]butyl]-pentylamino]-5-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 4-methyl-2-[pentyl-[4-(thiophene-3-carbonylamino)butanoyl]amino]-1,3-thiazole-5-carboxylate Traditional Name: 2-[amyl-[4-(3-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=CSC=C2

Isomeric SMILES

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

InChI

InChI=1S/C21H29N3O4S2/c1-4-6-7-12-24(21-23-15(3)18(30-21)20(27)28-5-2)17(25)9-8-11-22-19(26)16-10-13-29-14-16/h10,13-14H,4-9,11-12H2,1-3H3,(H,22,26)