1-[3-[3-(piperidin-1-ylmethyl)phenoxy]propylcarbamothioylamino]-3-propan-2-yl-urea

Systemtic Name: 1-[3-[3-(piperidin-1-ylmethyl)phenoxy]propylcarbamothioylamino]-3-propan-2-yl-urea Openeye Name: 1-isopropyl-3-[3-[3-(1-piperidylmethyl)phenoxy]propylcarbamothioylamino]urea CAS Name: 1-[[[3-[3-(1-piperidinylmethyl)phenoxy]propylamino]-sulfanylidenemethyl]amino]-3-propan-2-ylurea IUPAC Name: 1-[3-[3-(piperidin-1-ylmethyl)phenoxy]propylcarbamothioylamino]-3-propan-2-ylurea Traditional Name: 1-isopropyl-3-[3-[3-(piperidinomethyl)phenoxy]propylthiocarbamoylamino]urea Formula: C20H33N5O2S MolecularWeight: 407.57332

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H33N5O2S/c1-16(2)22-19(26)23-24-20(28)21-10-7-13-27-18-9-6-8-17(14-18)15-25-11-4-3-5-12-25/h6,8-9,14,16H,3-5,7,10-13,15H2,1-2H3,(H2,21,24,28)(H2,22,23,26)