3-butoxy-N-[[(2-propoxyphenyl)carbonylamino]carbamothioyl]benzamide

Systemtic Name: 3-butoxy-N-[[(2-propoxyphenyl)carbonylamino]carbamothioyl]benzamide Openeye Name: 3-butoxy-N-[[(2-propoxybenzoyl)amino]carbamothioyl]benzamide CAS Name: 3-butoxy-N-[[[oxo-(2-propoxyphenyl)methyl]hydrazo]-sulfanylidenemethyl]benzamide IUPAC Name: 3-butoxy-N-[[(2-propoxybenzoyl)amino]carbamothioyl]benzamide Traditional Name: 3-butoxy-N-[[(2-propoxybenzoyl)amino]thiocarbamoyl]benzamide Formula: C22H27N3O4S MolecularWeight: 429.53248

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=CC(=C1)C(=O)NC(=S)NNC(=O)C2=CC=CC=C2OCCC

Isomeric SMILES

CCCCOC1=CC=CC(=C1)C(=O)NC(=S)NNC(=O)C2=CC=CC=C2OCCC

InChI

InChI=1S/C22H27N3O4S/c1-3-5-14-28-17-10-8-9-16(15-17)20(26)23-22(30)25-24-21(27)18-11-6-7-12-19(18)29-13-4-2/h6-12,15H,3-5,13-14H2,1-2H3,(H,24,27)(H2,23,25,26,30)