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4-butylsulfinyl-N-[(octadecylcarbamoylamino)methyl]benzamide

4-butylsulfinyl-N-[(octadecylcarbamoylamino)methyl]benzamide

Systemtic Name:4-butylsulfinyl-N-[(octadecylcarbamoylamino)methyl]benzamide
Openeye Name:4-butylsulfinyl-N-[(octadecylcarbamoylamino)methyl]benzamide
CAS Name:4-butylsulfinyl-N-[[[(octadecylamino)-oxomethyl]amino]methyl]benzamide
IUPAC Name:4-butylsulfinyl-N-[(octadecylcarbamoylamino)methyl]benzamide
Traditional Name:4-butylsulfinyl-N-[(stearylcarbamoylamino)methyl]benzamide
Formula: C31H55N3O3S
MolecularWeight: 549.8517
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCNC(=O)NCNC(=O)C1=CC=C(C=C1)S(=O)CCCC


Isomeric SMILES

CCCCCCCCCCCCCCCCCCNC(=O)NCNC(=O)C1=CC=C(C=C1)S(=O)CCCC


InChI

InChI=1S/C31H55N3O3S/c1-3-5-7-8-9-10-11-12-13-14-15-16-17-18-19-20-25-32-31(36)34-27-33-30(35)28-21-23-29(24-22-28)38(37)26-6-4-2/h21-24H,3-20,25-27H2,1-2H3,(H,33,35)(H2,32,34,36)


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