1-[3-methyl-1-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-1-oxidanylidene-pentan-2-yl]urea

Systemtic Name: 1-[3-methyl-1-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-1-oxidanylidene-pentan-2-yl]urea Openeye Name: [2-methyl-1-[4-(p-tolylsulfonyl)piperazine-1-carbonyl]butyl]urea CAS Name: [3-methyl-1-[4-(4-methylphenyl)sulfonyl-1-piperazinyl]-1-oxopentan-2-yl]urea IUPAC Name: [3-methyl-1-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-1-oxopentan-2-yl]urea Traditional Name: [2-methyl-1-(4-tosylpiperazine-1-carbonyl)butyl]urea Formula: C18H28N4O4S MolecularWeight: 396.50432

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)N1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C)NC(=O)N

Isomeric SMILES

CCC(C)C(C(=O)N1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C)NC(=O)N

InChI

InChI=1S/C18H28N4O4S/c1-4-14(3)16(20-18(19)24)17(23)21-9-11-22(12-10-21)27(25,26)15-7-5-13(2)6-8-15/h5-8,14,16H,4,9-12H2,1-3H3,(H3,19,20,24)