1-(3,4-dihydro-1H-isoquinolin-2-yl)-4-[4-(4,6-dimethylpyrimidin-2-yl)piperazin-1-yl]butane-1,4-dione

Systemtic Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-4-[4-(4,6-dimethylpyrimidin-2-yl)piperazin-1-yl]butane-1,4-dione Openeye Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-4-[4-(4,6-dimethylpyrimidin-2-yl)piperazin-1-yl]butane-1,4-dione CAS Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-4-[4-(4,6-dimethyl-2-pyrimidinyl)-1-piperazinyl]butane-1,4-dione IUPAC Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-4-[4-(4,6-dimethylpyrimidin-2-yl)piperazin-1-yl]butane-1,4-dione Traditional Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-4-[4-(4,6-dimethylpyrimidin-2-yl)piperazino]butane-1,4-dione Formula: C23H29N5O2 MolecularWeight: 407.50866

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)N2CCN(CC2)C(=O)CCC(=O)N3CCC4=CC=CC=C4C3)C

Isomeric SMILES

CC1=CC(=NC(=N1)N2CCN(CC2)C(=O)CCC(=O)N3CCC4=CC=CC=C4C3)C

InChI

InChI=1S/C23H29N5O2/c1-17-15-18(2)25-23(24-17)27-13-11-26(12-14-27)21(29)7-8-22(30)28-10-9-19-5-3-4-6-20(19)16-28/h3-6,15H,7-14,16H2,1-2H3