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

Systemtic Name: 1,1-dimethyl-3-[3-[3-(piperidin-1-ylmethyl)phenoxy]propylcarbamothioylamino]urea Openeye Name: 1,1-dimethyl-3-[3-[3-(1-piperidylmethyl)phenoxy]propylcarbamothioylamino]urea CAS Name: 1,1-dimethyl-3-[[[3-[3-(1-piperidinylmethyl)phenoxy]propylamino]-sulfanylidenemethyl]amino]urea IUPAC Name: 1,1-dimethyl-3-[3-[3-(piperidin-1-ylmethyl)phenoxy]propylcarbamothioylamino]urea Traditional Name: 1,1-dimethyl-3-[3-[3-(piperidinomethyl)phenoxy]propylthiocarbamoylamino]urea Formula: C19H31N5O2S MolecularWeight: 393.54674

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)NNC(=S)NCCCOC1=CC=CC(=C1)CN2CCCCC2

Isomeric SMILES

CN(C)C(=O)NNC(=S)NCCCOC1=CC=CC(=C1)CN2CCCCC2

InChI

InChI=1S/C19H31N5O2S/c1-23(2)19(25)22-21-18(27)20-10-7-13-26-17-9-6-8-16(14-17)15-24-11-4-3-5-12-24/h6,8-9,14H,3-5,7,10-13,15H2,1-2H3,(H,22,25)(H2,20,21,27)