[4-(2,3-dimethylphenyl)piperazin-1-yl]-(2-pyrrolidin-1-ylpyrimidin-5-yl)methanone

Systemtic Name: [4-(2,3-dimethylphenyl)piperazin-1-yl]-(2-pyrrolidin-1-ylpyrimidin-5-yl)methanone Openeye Name: [4-(2,3-dimethylphenyl)piperazin-1-yl]-(2-pyrrolidin-1-ylpyrimidin-5-yl)methanone CAS Name: [4-(2,3-dimethylphenyl)-1-piperazinyl]-[2-(1-pyrrolidinyl)-5-pyrimidinyl]methanone IUPAC Name: [4-(2,3-dimethylphenyl)piperazin-1-yl]-(2-pyrrolidin-1-ylpyrimidin-5-yl)methanone Traditional Name: [4-(2,3-dimethylphenyl)piperazino]-(2-pyrrolidinopyrimidin-5-yl)methanone Formula: C21H27N5O MolecularWeight: 365.47198

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)N2CCN(CC2)C(=O)C3=CN=C(N=C3)N4CCCC4)C

Isomeric SMILES

CC1=C(C(=CC=C1)N2CCN(CC2)C(=O)C3=CN=C(N=C3)N4CCCC4)C

InChI

InChI=1S/C21H27N5O/c1-16-6-5-7-19(17(16)2)24-10-12-25(13-11-24)20(27)18-14-22-21(23-15-18)26-8-3-4-9-26/h5-7,14-15H,3-4,8-13H2,1-2H3