2-[4-(5,6-dimethoxypyrimidin-4-yl)piperazin-1-yl]-1-(5-methoxy-1H-indol-3-yl)propan-1-one

Systemtic Name: 2-[4-(5,6-dimethoxypyrimidin-4-yl)piperazin-1-yl]-1-(5-methoxy-1H-indol-3-yl)propan-1-one Openeye Name: 2-[4-(5,6-dimethoxypyrimidin-4-yl)piperazin-1-yl]-1-(5-methoxy-1H-indol-3-yl)propan-1-one CAS Name: 2-[4-(5,6-dimethoxy-4-pyrimidinyl)-1-piperazinyl]-1-(5-methoxy-1H-indol-3-yl)-1-propanone IUPAC Name: 2-[4-(5,6-dimethoxypyrimidin-4-yl)piperazin-1-yl]-1-(5-methoxy-1H-indol-3-yl)propan-1-one Traditional Name: 2-[4-(5,6-dimethoxypyrimidin-4-yl)piperazino]-1-(5-methoxy-1H-indol-3-yl)propan-1-one Formula: C22H27N5O4 MolecularWeight: 425.48088

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)C1=CNC2=C1C=C(C=C2)OC)N3CCN(CC3)C4=C(C(=NC=N4)OC)OC

Isomeric SMILES

CC(C(=O)C1=CNC2=C1C=C(C=C2)OC)N3CCN(CC3)C4=C(C(=NC=N4)OC)OC

InChI

InChI=1S/C22H27N5O4/c1-14(19(28)17-12-23-18-6-5-15(29-2)11-16(17)18)26-7-9-27(10-8-26)21-20(30-3)22(31-4)25-13-24-21/h5-6,11-14,23H,7-10H2,1-4H3