1-(2-methylquinolin-4-yl)-3-[2-(4-naphthalen-2-ylsulfonylpiperazin-1-yl)ethyl]urea

Systemtic Name: 1-(2-methylquinolin-4-yl)-3-[2-(4-naphthalen-2-ylsulfonylpiperazin-1-yl)ethyl]urea Openeye Name: 1-(2-methyl-4-quinolyl)-3-[2-[4-(2-naphthylsulfonyl)piperazin-1-yl]ethyl]urea CAS Name: 1-(2-methyl-4-quinolinyl)-3-[2-[4-(2-naphthalenylsulfonyl)-1-piperazinyl]ethyl]urea IUPAC Name: 1-(2-methylquinolin-4-yl)-3-[2-(4-naphthalen-2-ylsulfonylpiperazin-1-yl)ethyl]urea Traditional Name: 1-(2-methyl-4-quinolyl)-3-[2-[4-(2-naphthylsulfonyl)piperazino]ethyl]urea Formula: C27H29N5O3S MolecularWeight: 503.61586

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2C(=C1)NC(=O)NCCN3CCN(CC3)S(=O)(=O)C4=CC5=CC=CC=C5C=C4

Isomeric SMILES

CC1=NC2=CC=CC=C2C(=C1)NC(=O)NCCN3CCN(CC3)S(=O)(=O)C4=CC5=CC=CC=C5C=C4

InChI

InChI=1S/C27H29N5O3S/c1-20-18-26(24-8-4-5-9-25(24)29-20)30-27(33)28-12-13-31-14-16-32(17-15-31)36(34,35)23-11-10-21-6-2-3-7-22(21)19-23/h2-11,18-19H,12-17H2,1H3,(H2,28,29,30,33)