N-[(butanoylamino)carbamothioyl]-2-pentoxy-benzamide

Systemtic Name: N-[(butanoylamino)carbamothioyl]-2-pentoxy-benzamide Openeye Name: N-[(butanoylamino)carbamothioyl]-2-pentoxy-benzamide CAS Name: N-[(1-oxobutylhydrazo)-sulfanylidenemethyl]-2-pentoxybenzamide IUPAC Name: N-[(butanoylamino)carbamothioyl]-2-pentoxybenzamide Traditional Name: 2-amoxy-N-(butyramidothiocarbamoyl)benzamide Formula: C17H25N3O3S MolecularWeight: 351.4637

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=CC=CC=C1C(=O)NC(=S)NNC(=O)CCC

Isomeric SMILES

CCCCCOC1=CC=CC=C1C(=O)NC(=S)NNC(=O)CCC

InChI

InChI=1S/C17H25N3O3S/c1-3-5-8-12-23-14-11-7-6-10-13(14)16(22)18-17(24)20-19-15(21)9-4-2/h6-7,10-11H,3-5,8-9,12H2,1-2H3,(H,19,21)(H2,18,20,22,24)