(7-chloranyl-8-methyl-2-pyridin-4-yl-quinolin-4-yl)-(4-methylsulfonylpiperazin-1-yl)methanone

Systemtic Name: (7-chloranyl-8-methyl-2-pyridin-4-yl-quinolin-4-yl)-(4-methylsulfonylpiperazin-1-yl)methanone Openeye Name: [7-chloro-8-methyl-2-(4-pyridyl)-4-quinolyl]-(4-methylsulfonylpiperazin-1-yl)methanone CAS Name: (7-chloro-8-methyl-2-pyridin-4-yl-4-quinolinyl)-(4-methylsulfonyl-1-piperazinyl)methanone IUPAC Name: (7-chloro-8-methyl-2-pyridin-4-ylquinolin-4-yl)-(4-methylsulfonylpiperazin-1-yl)methanone Traditional Name: [7-chloro-8-methyl-2-(4-pyridyl)-4-quinolyl]-(4-mesylpiperazino)methanone Formula: C21H21ClN4O3S MolecularWeight: 444.93444

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC2=C1N=C(C=C2C(=O)N3CCN(CC3)S(=O)(=O)C)C4=CC=NC=C4)Cl

Isomeric SMILES

CC1=C(C=CC2=C1N=C(C=C2C(=O)N3CCN(CC3)S(=O)(=O)C)C4=CC=NC=C4)Cl

InChI

InChI=1S/C21H21ClN4O3S/c1-14-18(22)4-3-16-17(13-19(24-20(14)16)15-5-7-23-8-6-15)21(27)25-9-11-26(12-10-25)30(2,28)29/h3-8,13H,9-12H2,1-2H3