ethyl 2,5-dimethyl-1-[2-oxidanylidene-2-[(6-pyrrolidin-1-ylpyridin-3-yl)methylamino]ethyl]pyrrole-3-carboxylate

Systemtic Name: ethyl 2,5-dimethyl-1-[2-oxidanylidene-2-[(6-pyrrolidin-1-ylpyridin-3-yl)methylamino]ethyl]pyrrole-3-carboxylate Openeye Name: ethyl 2,5-dimethyl-1-[2-oxo-2-[(6-pyrrolidin-1-yl-3-pyridyl)methylamino]ethyl]pyrrole-3-carboxylate CAS Name: 2,5-dimethyl-1-[2-oxo-2-[[6-(1-pyrrolidinyl)-3-pyridinyl]methylamino]ethyl]-3-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl 2,5-dimethyl-1-[2-oxo-2-[(6-pyrrolidin-1-ylpyridin-3-yl)methylamino]ethyl]pyrrole-3-carboxylate Traditional Name: 1-[2-keto-2-[(6-pyrrolidino-3-pyridyl)methylamino]ethyl]-2,5-dimethyl-pyrrole-3-carboxylic acid ethyl ester Formula: C21H28N4O3 MolecularWeight: 384.47202

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C(=C1)C)CC(=O)NCC2=CN=C(C=C2)N3CCCC3)C

Isomeric SMILES

CCOC(=O)C1=C(N(C(=C1)C)CC(=O)NCC2=CN=C(C=C2)N3CCCC3)C

InChI

InChI=1S/C21H28N4O3/c1-4-28-21(27)18-11-15(2)25(16(18)3)14-20(26)23-13-17-7-8-19(22-12-17)24-9-5-6-10-24/h7-8,11-12H,4-6,9-10,13-14H2,1-3H3,(H,23,26)