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

Systemtic Name: methyl 1-ethyl-3,5-dimethyl-4-[2-[pyridin-4-ylmethyl(thiophen-2-ylcarbonyl)amino]propanoyl]pyrrole-2-carboxylate Openeye Name: methyl 1-ethyl-3,5-dimethyl-4-[2-[4-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]-(pyridin-4-ylmethyl)amino]propyl]-2-pyrrolecarboxylic acid methyl ester IUPAC Name: methyl 1-ethyl-3,5-dimethyl-4-[2-[pyridin-4-ylmethyl(thiophene-2-carbonyl)amino]propanoyl]pyrrole-2-carboxylate Traditional Name: 1-ethyl-3,5-dimethyl-4-[2-[4-pyridylmethyl(2-thenoyl)amino]propanoyl]pyrrole-2-carboxylic acid methyl ester Formula: C24H27N3O4S MolecularWeight: 453.55388

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C(=C1C(=O)OC)C)C(=O)C(C)N(CC2=CC=NC=C2)C(=O)C3=CC=CS3)C

Isomeric SMILES

CCN1C(=C(C(=C1C(=O)OC)C)C(=O)C(C)N(CC2=CC=NC=C2)C(=O)C3=CC=CS3)C

InChI

InChI=1S/C24H27N3O4S/c1-6-26-16(3)20(15(2)21(26)24(30)31-5)22(28)17(4)27(14-18-9-11-25-12-10-18)23(29)19-8-7-13-32-19/h7-13,17H,6,14H2,1-5H3