(6,8-dimethyl-2-pyridin-3-yl-quinolin-4-yl)-[4-(4-nitrophenyl)sulfonylpiperazin-1-yl]methanone

Systemtic Name: (6,8-dimethyl-2-pyridin-3-yl-quinolin-4-yl)-[4-(4-nitrophenyl)sulfonylpiperazin-1-yl]methanone Openeye Name: [6,8-dimethyl-2-(3-pyridyl)-4-quinolyl]-[4-(4-nitrophenyl)sulfonylpiperazin-1-yl]methanone CAS Name: [6,8-dimethyl-2-(3-pyridinyl)-4-quinolinyl]-[4-(4-nitrophenyl)sulfonyl-1-piperazinyl]methanone IUPAC Name: (6,8-dimethyl-2-pyridin-3-ylquinolin-4-yl)-[4-(4-nitrophenyl)sulfonylpiperazin-1-yl]methanone Traditional Name: [6,8-dimethyl-2-(3-pyridyl)-4-quinolyl]-(4-nosylpiperazino)methanone Formula: C27H25N5O5S MolecularWeight: 531.5829

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)C(=CC(=N2)C3=CN=CC=C3)C(=O)N4CCN(CC4)S(=O)(=O)C5=CC=C(C=C5)[N+](=O)[O-])C

Isomeric SMILES

CC1=CC(=C2C(=C1)C(=CC(=N2)C3=CN=CC=C3)C(=O)N4CCN(CC4)S(=O)(=O)C5=CC=C(C=C5)[N+](=O)[O-])C

InChI

InChI=1S/C27H25N5O5S/c1-18-14-19(2)26-23(15-18)24(16-25(29-26)20-4-3-9-28-17-20)27(33)30-10-12-31(13-11-30)38(36,37)22-7-5-21(6-8-22)32(34)35/h3-9,14-17H,10-13H2,1-2H3