methyl 2-[[4-[(1-thiophen-2-ylcarbonylpiperidin-3-yl)carbonylamino]phenyl]carbonylamino]ethanoate

Systemtic Name: methyl 2-[[4-[(1-thiophen-2-ylcarbonylpiperidin-3-yl)carbonylamino]phenyl]carbonylamino]ethanoate Openeye Name: methyl 2-[[4-[[1-(thiophene-2-carbonyl)piperidine-3-carbonyl]amino]benzoyl]amino]acetate CAS Name: 2-[[oxo-[4-[[oxo-[1-[oxo(thiophen-2-yl)methyl]-3-piperidinyl]methyl]amino]phenyl]methyl]amino]acetic acid methyl ester IUPAC Name: methyl 2-[[4-[[1-(thiophene-2-carbonyl)piperidine-3-carbonyl]amino]benzoyl]amino]acetate Traditional Name: 2-[[4-[[1-(2-thenoyl)nipecotoyl]amino]benzoyl]amino]acetic acid methyl ester Formula: C21H23N3O5S MolecularWeight: 429.48942

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CNC(=O)C1=CC=C(C=C1)NC(=O)C2CCCN(C2)C(=O)C3=CC=CS3

Isomeric SMILES

COC(=O)CNC(=O)C1=CC=C(C=C1)NC(=O)C2CCCN(C2)C(=O)C3=CC=CS3

InChI

InChI=1S/C21H23N3O5S/c1-29-18(25)12-22-19(26)14-6-8-16(9-7-14)23-20(27)15-4-2-10-24(13-15)21(28)17-5-3-11-30-17/h3,5-9,11,15H,2,4,10,12-13H2,1H3,(H,22,26)(H,23,27)