1-[5-[4-[4-[(2S)-butan-2-yl]phenyl]sulfonylpiperazin-1-yl]-5-oxidanylidene-pentyl]urea

Systemtic Name: 1-[5-[4-[4-[(2S)-butan-2-yl]phenyl]sulfonylpiperazin-1-yl]-5-oxidanylidene-pentyl]urea Openeye Name: [5-[4-[4-[(1S)-1-methylpropyl]phenyl]sulfonylpiperazin-1-yl]-5-oxo-pentyl]urea CAS Name: [5-[4-[4-[(2S)-butan-2-yl]phenyl]sulfonyl-1-piperazinyl]-5-oxopentyl]urea IUPAC Name: [5-[4-[4-[(2S)-butan-2-yl]phenyl]sulfonylpiperazin-1-yl]-5-oxopentyl]urea Traditional Name: [5-keto-5-[4-[4-[(1S)-1-methylpropyl]phenyl]sulfonylpiperazino]pentyl]urea Formula: C20H32N4O4S MolecularWeight: 424.55748

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC[C@H](C)C1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)CCCCNC(=O)N

InChI

InChI=1S/C20H32N4O4S/c1-3-16(2)17-7-9-18(10-8-17)29(27,28)24-14-12-23(13-15-24)19(25)6-4-5-11-22-20(21)26/h7-10,16H,3-6,11-15H2,1-2H3,(H3,21,22,26)/t16-/m0/s1