1-cyclohexyl-3-[3-[3-(piperidin-1-ylmethyl)phenoxy]propylcarbamothioylamino]urea

Systemtic Name: 1-cyclohexyl-3-[3-[3-(piperidin-1-ylmethyl)phenoxy]propylcarbamothioylamino]urea Openeye Name: 1-cyclohexyl-3-[3-[3-(1-piperidylmethyl)phenoxy]propylcarbamothioylamino]urea CAS Name: 1-cyclohexyl-3-[[[3-[3-(1-piperidinylmethyl)phenoxy]propylamino]-sulfanylidenemethyl]amino]urea IUPAC Name: 1-cyclohexyl-3-[3-[3-(piperidin-1-ylmethyl)phenoxy]propylcarbamothioylamino]urea Traditional Name: 1-cyclohexyl-3-[3-[3-(piperidinomethyl)phenoxy]propylthiocarbamoylamino]urea Formula: C23H37N5O2S MolecularWeight: 447.63718

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=O)NNC(=S)NCCCOC2=CC=CC(=C2)CN3CCCCC3

Isomeric SMILES

C1CCC(CC1)NC(=O)NNC(=S)NCCCOC2=CC=CC(=C2)CN3CCCCC3

InChI

InChI=1S/C23H37N5O2S/c29-22(25-20-10-3-1-4-11-20)26-27-23(31)24-13-8-16-30-21-12-7-9-19(17-21)18-28-14-5-2-6-15-28/h7,9,12,17,20H,1-6,8,10-11,13-16,18H2,(H2,24,27,31)(H2,25,26,29)