1-(4-bromanyl-1H-indol-3-yl)-2-[(2R)-2-methyl-4-pyridin-2-ylcarbonyl-piperazin-1-yl]ethane-1,2-dione

Systemtic Name: 1-(4-bromanyl-1H-indol-3-yl)-2-[(2R)-2-methyl-4-pyridin-2-ylcarbonyl-piperazin-1-yl]ethane-1,2-dione Openeye Name: 1-(4-bromo-1H-indol-3-yl)-2-[(2R)-2-methyl-4-(pyridine-2-carbonyl)piperazin-1-yl]ethane-1,2-dione CAS Name: 1-(4-bromo-1H-indol-3-yl)-2-[(2R)-2-methyl-4-[oxo(2-pyridinyl)methyl]-1-piperazinyl]ethane-1,2-dione IUPAC Name: 1-(4-bromo-1H-indol-3-yl)-2-[(2R)-2-methyl-4-(pyridine-2-carbonyl)piperazin-1-yl]ethane-1,2-dione Traditional Name: 1-(4-bromo-1H-indol-3-yl)-2-[(2R)-2-methyl-4-picolinoyl-piperazino]ethane-1,2-dione Formula: C21H19BrN4O3 MolecularWeight: 455.30456

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1C(=O)C(=O)C2=CNC3=C2C(=CC=C3)Br)C(=O)C4=CC=CC=N4

Isomeric SMILES

C[C@@H]1CN(CCN1C(=O)C(=O)C2=CNC3=C2C(=CC=C3)Br)C(=O)C4=CC=CC=N4

InChI

InChI=1S/C21H19BrN4O3/c1-13-12-25(20(28)17-6-2-3-8-23-17)9-10-26(13)21(29)19(27)14-11-24-16-7-4-5-15(22)18(14)16/h2-8,11,13,24H,9-10,12H2,1H3/t13-/m1/s1