ethyl 4-[[3-methyl-2-(thiophen-2-ylcarbonylamino)pentanoyl]amino]benzoate

Systemtic Name: ethyl 4-[[3-methyl-2-(thiophen-2-ylcarbonylamino)pentanoyl]amino]benzoate Openeye Name: ethyl 4-[[3-methyl-2-(thiophene-2-carbonylamino)pentanoyl]amino]benzoate CAS Name: 4-[[3-methyl-1-oxo-2-[[oxo(thiophen-2-yl)methyl]amino]pentyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[3-methyl-2-(thiophene-2-carbonylamino)pentanoyl]amino]benzoate Traditional Name: 4-[[3-methyl-2-(2-thenoylamino)pentanoyl]amino]benzoic acid ethyl ester Formula: C20H24N2O4S MolecularWeight: 388.48056

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)NC1=CC=C(C=C1)C(=O)OCC)NC(=O)C2=CC=CS2

Isomeric SMILES

CCC(C)C(C(=O)NC1=CC=C(C=C1)C(=O)OCC)NC(=O)C2=CC=CS2

InChI

InChI=1S/C20H24N2O4S/c1-4-13(3)17(22-18(23)16-7-6-12-27-16)19(24)21-15-10-8-14(9-11-15)20(25)26-5-2/h6-13,17H,4-5H2,1-3H3,(H,21,24)(H,22,23)