N-[[[4-(butanoylamino)phenyl]carbonylamino]carbamothioyl]-4-heptoxy-benzamide

Systemtic Name: N-[[[4-(butanoylamino)phenyl]carbonylamino]carbamothioyl]-4-heptoxy-benzamide Openeye Name: N-[[[4-(butanoylamino)benzoyl]amino]carbamothioyl]-4-heptoxy-benzamide CAS Name: 4-heptoxy-N-[[[oxo-[4-(1-oxobutylamino)phenyl]methyl]hydrazo]-sulfanylidenemethyl]benzamide IUPAC Name: N-[[[4-(butanoylamino)benzoyl]amino]carbamothioyl]-4-heptoxybenzamide Traditional Name: N-[[(4-butyramidobenzoyl)amino]thiocarbamoyl]-4-heptoxy-benzamide Formula: C26H34N4O4S MolecularWeight: 498.63756

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC1=CC=C(C=C1)C(=O)NC(=S)NNC(=O)C2=CC=C(C=C2)NC(=O)CCC

Isomeric SMILES

CCCCCCCOC1=CC=C(C=C1)C(=O)NC(=S)NNC(=O)C2=CC=C(C=C2)NC(=O)CCC

InChI

InChI=1S/C26H34N4O4S/c1-3-5-6-7-8-18-34-22-16-12-19(13-17-22)24(32)28-26(35)30-29-25(33)20-10-14-21(15-11-20)27-23(31)9-4-2/h10-17H,3-9,18H2,1-2H3,(H,27,31)(H,29,33)(H2,28,30,32,35)