N-butyl-3-[[[3-(butylcarbamoyl)phenyl]methylcarbamothioylamino]methyl]benzamide

Systemtic Name: N-butyl-3-[[[3-(butylcarbamoyl)phenyl]methylcarbamothioylamino]methyl]benzamide Openeye Name: N-butyl-3-[[[3-(butylcarbamoyl)phenyl]methylcarbamothioylamino]methyl]benzamide CAS Name: N-butyl-3-[[[[[3-[butylamino(oxo)methyl]phenyl]methylamino]-sulfanylidenemethyl]amino]methyl]benzamide IUPAC Name: N-butyl-3-[[[3-(butylcarbamoyl)phenyl]methylcarbamothioylamino]methyl]benzamide Traditional Name: N-butyl-3-[[[3-(butylcarbamoyl)benzyl]thiocarbamoylamino]methyl]benzamide Formula: C25H34N4O2S MolecularWeight: 454.62806

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)C1=CC(=CC=C1)CNC(=S)NCC2=CC=CC(=C2)C(=O)NCCCC

Isomeric SMILES

CCCCNC(=O)C1=CC(=CC=C1)CNC(=S)NCC2=CC=CC(=C2)C(=O)NCCCC

InChI

InChI=1S/C25H34N4O2S/c1-3-5-13-26-23(30)21-11-7-9-19(15-21)17-28-25(32)29-18-20-10-8-12-22(16-20)24(31)27-14-6-4-2/h7-12,15-16H,3-6,13-14,17-18H2,1-2H3,(H,26,30)(H,27,31)(H2,28,29,32)