2-[(1-methyl-4H-pyridin-3-yl)carbonylamino]butyl 2-[5-(phenylcarbonyl)thiophen-2-yl]propanoate

Systemtic Name: 2-[(1-methyl-4H-pyridin-3-yl)carbonylamino]butyl 2-[5-(phenylcarbonyl)thiophen-2-yl]propanoate Openeye Name: 2-[(1-methyl-4H-pyridine-3-carbonyl)amino]butyl 2-(5-benzoyl-2-thienyl)propanoate CAS Name: 2-(5-benzoyl-2-thiophenyl)propanoic acid 2-[[(1-methyl-4H-pyridin-3-yl)-oxomethyl]amino]butyl ester IUPAC Name: 2-[(1-methyl-4H-pyridine-3-carbonyl)amino]butyl 2-(5-benzoylthiophen-2-yl)propanoate Traditional Name: 2-(5-benzoyl-2-thienyl)propionic acid 2-[(1-methyl-4H-pyridine-3-carbonyl)amino]butyl ester Formula: C25H28N2O4S MolecularWeight: 452.56582

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Descriptors Computed from Structure

Canonical SMILES:

CCC(COC(=O)C(C)C1=CC=C(S1)C(=O)C2=CC=CC=C2)NC(=O)C3=CN(C=CC3)C

Isomeric SMILES

CCC(COC(=O)C(C)C1=CC=C(S1)C(=O)C2=CC=CC=C2)NC(=O)C3=CN(C=CC3)C

InChI

InChI=1S/C25H28N2O4S/c1-4-20(26-24(29)19-11-8-14-27(3)15-19)16-31-25(30)17(2)21-12-13-22(32-21)23(28)18-9-6-5-7-10-18/h5-10,12-15,17,20H,4,11,16H2,1-3H3,(H,26,29)