N-butyl-4-[(4-ethoxyphenyl)carbonylcarbamothioylamino]benzamide

Systemtic Name: N-butyl-4-[(4-ethoxyphenyl)carbonylcarbamothioylamino]benzamide Openeye Name: N-butyl-4-[(4-ethoxybenzoyl)carbamothioylamino]benzamide CAS Name: N-butyl-4-[[[[(4-ethoxyphenyl)-oxomethyl]amino]-sulfanylidenemethyl]amino]benzamide IUPAC Name: N-butyl-4-[(4-ethoxybenzoyl)carbamothioylamino]benzamide Traditional Name: N-butyl-4-[(4-ethoxybenzoyl)thiocarbamoylamino]benzamide Formula: C21H25N3O3S MolecularWeight: 399.5065

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)C1=CC=C(C=C1)NC(=S)NC(=O)C2=CC=C(C=C2)OCC

Isomeric SMILES

CCCCNC(=O)C1=CC=C(C=C1)NC(=S)NC(=O)C2=CC=C(C=C2)OCC

InChI

InChI=1S/C21H25N3O3S/c1-3-5-14-22-19(25)15-6-10-17(11-7-15)23-21(28)24-20(26)16-8-12-18(13-9-16)27-4-2/h6-13H,3-5,14H2,1-2H3,(H,22,25)(H2,23,24,26,28)