ethyl 1-ethyl-3,5-dimethyl-4-[2-[pyridin-3-ylmethyl(thiophen-2-ylcarbonyl)amino]propanoyl]pyrrole-2-carboxylate

Systemtic Name: ethyl 1-ethyl-3,5-dimethyl-4-[2-[pyridin-3-ylmethyl(thiophen-2-ylcarbonyl)amino]propanoyl]pyrrole-2-carboxylate Openeye Name: ethyl 1-ethyl-3,5-dimethyl-4-[2-[3-pyridylmethyl(thiophene-2-carbonyl)amino]propanoyl]pyrrole-2-carboxylate CAS Name: 1-ethyl-3,5-dimethyl-4-[1-oxo-2-[[oxo(thiophen-2-yl)methyl]-(3-pyridinylmethyl)amino]propyl]-2-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-ethyl-3,5-dimethyl-4-[2-[pyridin-3-ylmethyl(thiophene-2-carbonyl)amino]propanoyl]pyrrole-2-carboxylate Traditional Name: 1-ethyl-3,5-dimethyl-4-[2-[3-pyridylmethyl(2-thenoyl)amino]propanoyl]pyrrole-2-carboxylic acid ethyl ester Formula: C25H29N3O4S MolecularWeight: 467.58046

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C(=C1C(=O)OCC)C)C(=O)C(C)N(CC2=CN=CC=C2)C(=O)C3=CC=CS3)C

Isomeric SMILES

CCN1C(=C(C(=C1C(=O)OCC)C)C(=O)C(C)N(CC2=CN=CC=C2)C(=O)C3=CC=CS3)C

InChI

InChI=1S/C25H29N3O4S/c1-6-27-17(4)21(16(3)22(27)25(31)32-7-2)23(29)18(5)28(15-19-10-8-12-26-14-19)24(30)20-11-9-13-33-20/h8-14,18H,6-7,15H2,1-5H3