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

Systemtic Name: 3-propoxy-N-[[(2-propoxyphenyl)carbonylamino]carbamothioyl]benzamide Openeye Name: 3-propoxy-N-[[(2-propoxybenzoyl)amino]carbamothioyl]benzamide CAS Name: N-[[[oxo-(2-propoxyphenyl)methyl]hydrazo]-sulfanylidenemethyl]-3-propoxybenzamide IUPAC Name: 3-propoxy-N-[[(2-propoxybenzoyl)amino]carbamothioyl]benzamide Traditional Name: 3-propoxy-N-[[(2-propoxybenzoyl)amino]thiocarbamoyl]benzamide Formula: C21H25N3O4S MolecularWeight: 415.5059

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=CC(=C1)C(=O)NC(=S)NNC(=O)C2=CC=CC=C2OCCC

Isomeric SMILES

CCCOC1=CC=CC(=C1)C(=O)NC(=S)NNC(=O)C2=CC=CC=C2OCCC

InChI

InChI=1S/C21H25N3O4S/c1-3-12-27-16-9-7-8-15(14-16)19(25)22-21(29)24-23-20(26)17-10-5-6-11-18(17)28-13-4-2/h5-11,14H,3-4,12-13H2,1-2H3,(H,23,26)(H2,22,24,25,29)