1-(2-methylquinolin-4-yl)-3-[2-[4-(2-methylsulfonylphenyl)sulfonylpiperazin-1-yl]ethyl]urea

Systemtic Name: 1-(2-methylquinolin-4-yl)-3-[2-[4-(2-methylsulfonylphenyl)sulfonylpiperazin-1-yl]ethyl]urea Openeye Name: 1-(2-methyl-4-quinolyl)-3-[2-[4-(2-methylsulfonylphenyl)sulfonylpiperazin-1-yl]ethyl]urea CAS Name: 1-(2-methyl-4-quinolinyl)-3-[2-[4-(2-methylsulfonylphenyl)sulfonyl-1-piperazinyl]ethyl]urea IUPAC Name: 1-(2-methylquinolin-4-yl)-3-[2-[4-(2-methylsulfonylphenyl)sulfonylpiperazin-1-yl]ethyl]urea Traditional Name: 1-[2-[4-(2-mesylphenyl)sulfonylpiperazino]ethyl]-3-(2-methyl-4-quinolyl)urea Formula: C24H29N5O5S2 MolecularWeight: 531.64756

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2C(=C1)NC(=O)NCCN3CCN(CC3)S(=O)(=O)C4=CC=CC=C4S(=O)(=O)C

Isomeric SMILES

CC1=NC2=CC=CC=C2C(=C1)NC(=O)NCCN3CCN(CC3)S(=O)(=O)C4=CC=CC=C4S(=O)(=O)C

InChI

InChI=1S/C24H29N5O5S2/c1-18-17-21(19-7-3-4-8-20(19)26-18)27-24(30)25-11-12-28-13-15-29(16-14-28)36(33,34)23-10-6-5-9-22(23)35(2,31)32/h3-10,17H,11-16H2,1-2H3,(H2,25,26,27,30)