N-[3-(1H-indol-3-yl)-1-oxidanylidene-1-(4-pyrimidin-2-ylpiperazin-1-yl)propan-2-yl]ethanamide

Systemtic Name: N-[3-(1H-indol-3-yl)-1-oxidanylidene-1-(4-pyrimidin-2-ylpiperazin-1-yl)propan-2-yl]ethanamide Openeye Name: N-[1-(1H-indol-3-ylmethyl)-2-oxo-2-(4-pyrimidin-2-ylpiperazin-1-yl)ethyl]acetamide CAS Name: N-[3-(1H-indol-3-yl)-1-oxo-1-[4-(2-pyrimidinyl)-1-piperazinyl]propan-2-yl]acetamide IUPAC Name: N-[3-(1H-indol-3-yl)-1-oxo-1-(4-pyrimidin-2-ylpiperazin-1-yl)propan-2-yl]acetamide Traditional Name: N-[1-(1H-indol-3-ylmethyl)-2-keto-2-[4-(2-pyrimidyl)piperazino]ethyl]acetamide Formula: C21H24N6O2 MolecularWeight: 392.45426

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(CC1=CNC2=CC=CC=C21)C(=O)N3CCN(CC3)C4=NC=CC=N4

Isomeric SMILES

CC(=O)NC(CC1=CNC2=CC=CC=C21)C(=O)N3CCN(CC3)C4=NC=CC=N4

InChI

InChI=1S/C21H24N6O2/c1-15(28)25-19(13-16-14-24-18-6-3-2-5-17(16)18)20(29)26-9-11-27(12-10-26)21-22-7-4-8-23-21/h2-8,14,19,24H,9-13H2,1H3,(H,25,28)