3-butoxy-N-[(4-butoxyphenyl)carbamothioyl]benzamide

Systemtic Name: 3-butoxy-N-[(4-butoxyphenyl)carbamothioyl]benzamide Openeye Name: 3-butoxy-N-[(4-butoxyphenyl)carbamothioyl]benzamide CAS Name: 3-butoxy-N-[(4-butoxyanilino)-sulfanylidenemethyl]benzamide IUPAC Name: 3-butoxy-N-[(4-butoxyphenyl)carbamothioyl]benzamide Traditional Name: 3-butoxy-N-[(4-butoxyphenyl)thiocarbamoyl]benzamide Formula: C22H28N2O3S MolecularWeight: 400.53432

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)NC(=S)NC(=O)C2=CC(=CC=C2)OCCCC

Isomeric SMILES

CCCCOC1=CC=C(C=C1)NC(=S)NC(=O)C2=CC(=CC=C2)OCCCC

InChI

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