4-[2-(butan-2-ylamino)pyrimidin-4-yl]-3-phenyl-piperazin-2-one

Systemtic Name: 4-[2-(butan-2-ylamino)pyrimidin-4-yl]-3-phenyl-piperazin-2-one Openeye Name: 3-phenyl-4-[2-(sec-butylamino)pyrimidin-4-yl]piperazin-2-one CAS Name: 4-[2-(butan-2-ylamino)-4-pyrimidinyl]-3-phenyl-2-piperazinone IUPAC Name: 4-[2-(butan-2-ylamino)pyrimidin-4-yl]-3-phenylpiperazin-2-one Traditional Name: 3-phenyl-4-[2-(sec-butylamino)pyrimidin-4-yl]piperazin-2-one Formula: C18H23N5O MolecularWeight: 325.40812

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC1=NC=CC(=N1)N2CCNC(=O)C2C3=CC=CC=C3

Isomeric SMILES

CCC(C)NC1=NC=CC(=N1)N2CCNC(=O)C2C3=CC=CC=C3

InChI

InChI=1S/C18H23N5O/c1-3-13(2)21-18-20-10-9-15(22-18)23-12-11-19-17(24)16(23)14-7-5-4-6-8-14/h4-10,13,16H,3,11-12H2,1-2H3,(H,19,24)(H,20,21,22)