(1-ethyl-2,5-dimethyl-pyrrol-3-yl)-(4-pyrimidin-2-ylpiperazin-1-yl)methanone

Systemtic Name: (1-ethyl-2,5-dimethyl-pyrrol-3-yl)-(4-pyrimidin-2-ylpiperazin-1-yl)methanone Openeye Name: (1-ethyl-2,5-dimethyl-pyrrol-3-yl)-(4-pyrimidin-2-ylpiperazin-1-yl)methanone CAS Name: (1-ethyl-2,5-dimethyl-3-pyrrolyl)-[4-(2-pyrimidinyl)-1-piperazinyl]methanone IUPAC Name: (1-ethyl-2,5-dimethylpyrrol-3-yl)-(4-pyrimidin-2-ylpiperazin-1-yl)methanone Traditional Name: (1-ethyl-2,5-dimethyl-pyrrol-3-yl)-[4-(2-pyrimidyl)piperazino]methanone Formula: C17H23N5O MolecularWeight: 313.39742

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=CC(=C1C)C(=O)N2CCN(CC2)C3=NC=CC=N3)C

Isomeric SMILES

CCN1C(=CC(=C1C)C(=O)N2CCN(CC2)C3=NC=CC=N3)C

InChI

InChI=1S/C17H23N5O/c1-4-22-13(2)12-15(14(22)3)16(23)20-8-10-21(11-9-20)17-18-6-5-7-19-17/h5-7,12H,4,8-11H2,1-3H3