1-[5-[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-yl]-5-oxidanylidene-pentyl]urea

Systemtic Name: 1-[5-[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-yl]-5-oxidanylidene-pentyl]urea Openeye Name: [5-[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-yl]-5-oxo-pentyl]urea CAS Name: [5-[4-(2,5-dimethylphenyl)sulfonyl-1-piperazinyl]-5-oxopentyl]urea IUPAC Name: [5-[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-yl]-5-oxopentyl]urea Traditional Name: [5-[4-(2,5-dimethylphenyl)sulfonylpiperazino]-5-keto-pentyl]urea Formula: C18H28N4O4S MolecularWeight: 396.50432

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)S(=O)(=O)N2CCN(CC2)C(=O)CCCCNC(=O)N

Isomeric SMILES

CC1=CC(=C(C=C1)C)S(=O)(=O)N2CCN(CC2)C(=O)CCCCNC(=O)N

InChI

InChI=1S/C18H28N4O4S/c1-14-6-7-15(2)16(13-14)27(25,26)22-11-9-21(10-12-22)17(23)5-3-4-8-20-18(19)24/h6-7,13H,3-5,8-12H2,1-2H3,(H3,19,20,24)