N-[(hexanoylamino)carbamothioyl]-3-(2-methylpropoxy)benzamide

Systemtic Name: N-[(hexanoylamino)carbamothioyl]-3-(2-methylpropoxy)benzamide Openeye Name: N-[(hexanoylamino)carbamothioyl]-3-isobutoxy-benzamide CAS Name: 3-(2-methylpropoxy)-N-[(1-oxohexylhydrazo)-sulfanylidenemethyl]benzamide IUPAC Name: N-[(hexanoylamino)carbamothioyl]-3-(2-methylpropoxy)benzamide Traditional Name: N-[(caproylamino)thiocarbamoyl]-3-isobutoxy-benzamide Formula: C18H27N3O3S MolecularWeight: 365.49028

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H27N3O3S/c1-4-5-6-10-16(22)20-21-18(25)19-17(23)14-8-7-9-15(11-14)24-12-13(2)3/h7-9,11,13H,4-6,10,12H2,1-3H3,(H,20,22)(H2,19,21,23,25)