1-(3-methyl-2-morpholin-4-yl-butyl)-3-[(2-morpholin-4-ylsulfonylphenyl)methyl]urea

Systemtic Name: 1-(3-methyl-2-morpholin-4-yl-butyl)-3-[(2-morpholin-4-ylsulfonylphenyl)methyl]urea Openeye Name: 1-(3-methyl-2-morpholino-butyl)-3-[(2-morpholinosulfonylphenyl)methyl]urea CAS Name: 1-[3-methyl-2-(4-morpholinyl)butyl]-3-[[2-(4-morpholinylsulfonyl)phenyl]methyl]urea IUPAC Name: 1-(3-methyl-2-morpholin-4-ylbutyl)-3-[(2-morpholin-4-ylsulfonylphenyl)methyl]urea Traditional Name: 1-(3-methyl-2-morpholino-butyl)-3-(2-morpholinosulfonylbenzyl)urea Formula: C21H34N4O5S MolecularWeight: 454.58346

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(CNC(=O)NCC1=CC=CC=C1S(=O)(=O)N2CCOCC2)N3CCOCC3

Isomeric SMILES

CC(C)C(CNC(=O)NCC1=CC=CC=C1S(=O)(=O)N2CCOCC2)N3CCOCC3

InChI

InChI=1S/C21H34N4O5S/c1-17(2)19(24-7-11-29-12-8-24)16-23-21(26)22-15-18-5-3-4-6-20(18)31(27,28)25-9-13-30-14-10-25/h3-6,17,19H,7-16H2,1-2H3,(H2,22,23,26)