N-[3-[3-[(4-butyl-2-methyl-phenyl)carbamothioylamino]propoxy]phenyl]ethanamide

Systemtic Name: N-[3-[3-[(4-butyl-2-methyl-phenyl)carbamothioylamino]propoxy]phenyl]ethanamide Openeye Name: N-[3-[3-[(4-butyl-2-methyl-phenyl)carbamothioylamino]propoxy]phenyl]acetamide CAS Name: N-[3-[3-[[(4-butyl-2-methylanilino)-sulfanylidenemethyl]amino]propoxy]phenyl]acetamide IUPAC Name: N-[3-[3-[(4-butyl-2-methylphenyl)carbamothioylamino]propoxy]phenyl]acetamide Traditional Name: N-[3-[3-[(4-butyl-2-methyl-phenyl)thiocarbamoylamino]propoxy]phenyl]acetamide Formula: C23H31N3O2S MolecularWeight: 413.57614

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC(=C(C=C1)NC(=S)NCCCOC2=CC=CC(=C2)NC(=O)C)C

Isomeric SMILES

CCCCC1=CC(=C(C=C1)NC(=S)NCCCOC2=CC=CC(=C2)NC(=O)C)C

InChI

InChI=1S/C23H31N3O2S/c1-4-5-8-19-11-12-22(17(2)15-19)26-23(29)24-13-7-14-28-21-10-6-9-20(16-21)25-18(3)27/h6,9-12,15-16H,4-5,7-8,13-14H2,1-3H3,(H,25,27)(H2,24,26,29)