1-[4-(3-chlorophenyl)piperazin-1-yl]-3-(pyrimidin-2-ylamino)propan-1-one

Systemtic Name: 1-[4-(3-chlorophenyl)piperazin-1-yl]-3-(pyrimidin-2-ylamino)propan-1-one Openeye Name: 1-[4-(3-chlorophenyl)piperazin-1-yl]-3-(pyrimidin-2-ylamino)propan-1-one CAS Name: 1-[4-(3-chlorophenyl)-1-piperazinyl]-3-(2-pyrimidinylamino)-1-propanone IUPAC Name: 1-[4-(3-chlorophenyl)piperazin-1-yl]-3-(pyrimidin-2-ylamino)propan-1-one Traditional Name: 1-[4-(3-chlorophenyl)piperazino]-3-(2-pyrimidylamino)propan-1-one Formula: C17H20ClN5O MolecularWeight: 345.8266

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC(=CC=C2)Cl)C(=O)CCNC3=NC=CC=N3

Isomeric SMILES

C1CN(CCN1C2=CC(=CC=C2)Cl)C(=O)CCNC3=NC=CC=N3

InChI

InChI=1S/C17H20ClN5O/c18-14-3-1-4-15(13-14)22-9-11-23(12-10-22)16(24)5-8-21-17-19-6-2-7-20-17/h1-4,6-7,13H,5,8-12H2,(H,19,20,21)