N-[[(2-butoxyphenyl)carbonylamino]carbamothioyl]pentanamide

Systemtic Name: N-[[(2-butoxyphenyl)carbonylamino]carbamothioyl]pentanamide Openeye Name: N-[[(2-butoxybenzoyl)amino]carbamothioyl]pentanamide CAS Name: N-[[[(2-butoxyphenyl)-oxomethyl]hydrazo]-sulfanylidenemethyl]pentanamide IUPAC Name: N-[[(2-butoxybenzoyl)amino]carbamothioyl]pentanamide Traditional Name: N-[[(2-butoxybenzoyl)amino]thiocarbamoyl]valeramide Formula: C17H25N3O3S MolecularWeight: 351.4637

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)NC(=S)NNC(=O)C1=CC=CC=C1OCCCC

Isomeric SMILES

CCCCC(=O)NC(=S)NNC(=O)C1=CC=CC=C1OCCCC

InChI

InChI=1S/C17H25N3O3S/c1-3-5-11-15(21)18-17(24)20-19-16(22)13-9-7-8-10-14(13)23-12-6-4-2/h7-10H,3-6,11-12H2,1-2H3,(H,19,22)(H2,18,20,21,24)