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1-(octadecanoylamino)-3-(phenylmethyl)thiourea

1-(octadecanoylamino)-3-(phenylmethyl)thiourea

Systemtic Name:1-(octadecanoylamino)-3-(phenylmethyl)thiourea
Openeye Name:1-benzyl-3-(octadecanoylamino)thiourea
CAS Name:1-(1-oxooctadecylamino)-3-(phenylmethyl)thiourea
IUPAC Name:1-benzyl-3-(octadecanoylamino)thiourea
Traditional Name:1-benzyl-3-stearamido-thiourea
Formula: C26H45N3OS
MolecularWeight: 447.72
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC(=O)NNC(=S)NCC1=CC=CC=C1


Isomeric SMILES

CCCCCCCCCCCCCCCCCC(=O)NNC(=S)NCC1=CC=CC=C1


InChI

InChI=1S/C26H45N3OS/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-19-22-25(30)28-29-26(31)27-23-24-20-17-16-18-21-24/h16-18,20-21H,2-15,19,22-23H2,1H3,(H,28,30)(H2,27,29,31)


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