3-butoxy-N-[(2-butoxyphenyl)carbamothioyl]benzamide

Systemtic Name: 3-butoxy-N-[(2-butoxyphenyl)carbamothioyl]benzamide Openeye Name: 3-butoxy-N-[(2-butoxyphenyl)carbamothioyl]benzamide CAS Name: 3-butoxy-N-[(2-butoxyanilino)-sulfanylidenemethyl]benzamide IUPAC Name: 3-butoxy-N-[(2-butoxyphenyl)carbamothioyl]benzamide Traditional Name: 3-butoxy-N-[(2-butoxyphenyl)thiocarbamoyl]benzamide Formula: C22H28N2O3S MolecularWeight: 400.53432

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=CC(=C1)C(=O)NC(=S)NC2=CC=CC=C2OCCCC

Isomeric SMILES

CCCCOC1=CC=CC(=C1)C(=O)NC(=S)NC2=CC=CC=C2OCCCC

InChI

InChI=1S/C22H28N2O3S/c1-3-5-14-26-18-11-9-10-17(16-18)21(25)24-22(28)23-19-12-7-8-13-20(19)27-15-6-4-2/h7-13,16H,3-6,14-15H2,1-2H3,(H2,23,24,25,28)