(6-bromanyl-2-pyridin-4-yl-quinolin-4-yl)-(4-thiophen-2-ylsulfonylpiperazin-1-yl)methanone

Systemtic Name: (6-bromanyl-2-pyridin-4-yl-quinolin-4-yl)-(4-thiophen-2-ylsulfonylpiperazin-1-yl)methanone Openeye Name: [6-bromo-2-(4-pyridyl)-4-quinolyl]-[4-(2-thienylsulfonyl)piperazin-1-yl]methanone CAS Name: (6-bromo-2-pyridin-4-yl-4-quinolinyl)-(4-thiophen-2-ylsulfonyl-1-piperazinyl)methanone IUPAC Name: (6-bromo-2-pyridin-4-ylquinolin-4-yl)-(4-thiophen-2-ylsulfonylpiperazin-1-yl)methanone Traditional Name: [6-bromo-2-(4-pyridyl)-4-quinolyl]-[4-(2-thienylsulfonyl)piperazino]methanone Formula: C23H19BrN4O3S2 MolecularWeight: 543.45596

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)C2=CC(=NC3=C2C=C(C=C3)Br)C4=CC=NC=C4)S(=O)(=O)C5=CC=CS5

Isomeric SMILES

C1CN(CCN1C(=O)C2=CC(=NC3=C2C=C(C=C3)Br)C4=CC=NC=C4)S(=O)(=O)C5=CC=CS5

InChI

InChI=1S/C23H19BrN4O3S2/c24-17-3-4-20-18(14-17)19(15-21(26-20)16-5-7-25-8-6-16)23(29)27-9-11-28(12-10-27)33(30,31)22-2-1-13-32-22/h1-8,13-15H,9-12H2