[4-[2,6-bis(diethylamino)-5-(phenylcarbonyl)pyrimidin-4-yl]piperazin-1-yl]-pyrrolidin-2-yl-methanone

Systemtic Name: [4-[2,6-bis(diethylamino)-5-(phenylcarbonyl)pyrimidin-4-yl]piperazin-1-yl]-pyrrolidin-2-yl-methanone Openeye Name: [4-[5-benzoyl-2,6-bis(diethylamino)pyrimidin-4-yl]piperazin-1-yl]-pyrrolidin-2-yl-methanone CAS Name: [4-[5-benzoyl-2,6-bis(diethylamino)-4-pyrimidinyl]-1-piperazinyl]-(2-pyrrolidinyl)methanone IUPAC Name: [4-[5-benzoyl-2,6-bis(diethylamino)pyrimidin-4-yl]piperazin-1-yl]-pyrrolidin-2-ylmethanone Traditional Name: [4-[5-benzoyl-2,6-bis(diethylamino)pyrimidin-4-yl]piperazino]-pyrrolidin-2-yl-methanone Formula: C28H41N7O2 MolecularWeight: 507.67084

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=NC(=NC(=C1C(=O)C2=CC=CC=C2)N3CCN(CC3)C(=O)C4CCCN4)N(CC)CC

Isomeric SMILES

CCN(CC)C1=NC(=NC(=C1C(=O)C2=CC=CC=C2)N3CCN(CC3)C(=O)C4CCCN4)N(CC)CC

InChI

InChI=1S/C28H41N7O2/c1-5-32(6-2)25-23(24(36)21-13-10-9-11-14-21)26(31-28(30-25)33(7-3)8-4)34-17-19-35(20-18-34)27(37)22-15-12-16-29-22/h9-11,13-14,22,29H,5-8,12,15-20H2,1-4H3