3-bromanyl-N-[(butanoylamino)carbamothioyl]-4-propoxy-benzamide

Systemtic Name: 3-bromanyl-N-[(butanoylamino)carbamothioyl]-4-propoxy-benzamide Openeye Name: 3-bromo-N-[(butanoylamino)carbamothioyl]-4-propoxy-benzamide CAS Name: 3-bromo-N-[(1-oxobutylhydrazo)-sulfanylidenemethyl]-4-propoxybenzamide IUPAC Name: 3-bromo-N-[(butanoylamino)carbamothioyl]-4-propoxybenzamide Traditional Name: 3-bromo-N-(butyramidothiocarbamoyl)-4-propoxy-benzamide Formula: C15H20BrN3O3S MolecularWeight: 402.3066

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)NNC(=S)NC(=O)C1=CC(=C(C=C1)OCCC)Br

Isomeric SMILES

CCCC(=O)NNC(=S)NC(=O)C1=CC(=C(C=C1)OCCC)Br

InChI

InChI=1S/C15H20BrN3O3S/c1-3-5-13(20)18-19-15(23)17-14(21)10-6-7-12(11(16)9-10)22-8-4-2/h6-7,9H,3-5,8H2,1-2H3,(H,18,20)(H2,17,19,21,23)