N-[(hexanoylamino)carbamothioyl]-3-propan-2-yloxy-benzamide

Systemtic Name: N-[(hexanoylamino)carbamothioyl]-3-propan-2-yloxy-benzamide Openeye Name: N-[(hexanoylamino)carbamothioyl]-3-isopropoxy-benzamide CAS Name: N-[(1-oxohexylhydrazo)-sulfanylidenemethyl]-3-propan-2-yloxybenzamide IUPAC Name: N-[(hexanoylamino)carbamothioyl]-3-propan-2-yloxybenzamide Traditional Name: N-[(caproylamino)thiocarbamoyl]-3-isopropoxy-benzamide Formula: C17H25N3O3S MolecularWeight: 351.4637

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)NNC(=S)NC(=O)C1=CC(=CC=C1)OC(C)C

Isomeric SMILES

CCCCCC(=O)NNC(=S)NC(=O)C1=CC(=CC=C1)OC(C)C

InChI

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