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

Systemtic Name: 1-methyl-3-[3-[3-(piperidin-1-ylmethyl)phenoxy]propylcarbamothioylamino]urea Openeye Name: 1-methyl-3-[3-[3-(1-piperidylmethyl)phenoxy]propylcarbamothioylamino]urea CAS Name: 1-methyl-3-[[[3-[3-(1-piperidinylmethyl)phenoxy]propylamino]-sulfanylidenemethyl]amino]urea IUPAC Name: 1-methyl-3-[3-[3-(piperidin-1-ylmethyl)phenoxy]propylcarbamothioylamino]urea Traditional Name: 1-methyl-3-[3-[3-(piperidinomethyl)phenoxy]propylthiocarbamoylamino]urea Formula: C18H29N5O2S MolecularWeight: 379.52016

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)NNC(=S)NCCCOC1=CC=CC(=C1)CN2CCCCC2

Isomeric SMILES

CNC(=O)NNC(=S)NCCCOC1=CC=CC(=C1)CN2CCCCC2

InChI

InChI=1S/C18H29N5O2S/c1-19-17(24)21-22-18(26)20-9-6-12-25-16-8-5-7-15(13-16)14-23-10-3-2-4-11-23/h5,7-8,13H,2-4,6,9-12,14H2,1H3,(H2,19,21,24)(H2,20,22,26)