ethyl 2,5-dimethyl-1-[2-oxidanylidene-2-(4-pyrazin-2-ylpiperazin-1-yl)ethyl]pyrrole-3-carboxylate

Systemtic Name: ethyl 2,5-dimethyl-1-[2-oxidanylidene-2-(4-pyrazin-2-ylpiperazin-1-yl)ethyl]pyrrole-3-carboxylate Openeye Name: ethyl 2,5-dimethyl-1-[2-oxo-2-(4-pyrazin-2-ylpiperazin-1-yl)ethyl]pyrrole-3-carboxylate CAS Name: 2,5-dimethyl-1-[2-oxo-2-[4-(2-pyrazinyl)-1-piperazinyl]ethyl]-3-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl 2,5-dimethyl-1-[2-oxo-2-(4-pyrazin-2-ylpiperazin-1-yl)ethyl]pyrrole-3-carboxylate Traditional Name: 1-[2-keto-2-(4-pyrazin-2-ylpiperazino)ethyl]-2,5-dimethyl-pyrrole-3-carboxylic acid ethyl ester Formula: C19H25N5O3 MolecularWeight: 371.4335

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C(=C1)C)CC(=O)N2CCN(CC2)C3=NC=CN=C3)C

Isomeric SMILES

CCOC(=O)C1=C(N(C(=C1)C)CC(=O)N2CCN(CC2)C3=NC=CN=C3)C

InChI

InChI=1S/C19H25N5O3/c1-4-27-19(26)16-11-14(2)24(15(16)3)13-18(25)23-9-7-22(8-10-23)17-12-20-5-6-21-17/h5-6,11-12H,4,7-10,13H2,1-3H3