N-[[[4-(pentanoylamino)phenyl]carbonylamino]carbamothioyl]cyclohexanecarboxamide

Systemtic Name: N-[[[4-(pentanoylamino)phenyl]carbonylamino]carbamothioyl]cyclohexanecarboxamide Openeye Name: N-[[[4-(pentanoylamino)benzoyl]amino]carbamothioyl]cyclohexanecarboxamide CAS Name: N-[[[oxo-[4-(1-oxopentylamino)phenyl]methyl]hydrazo]-sulfanylidenemethyl]cyclohexanecarboxamide IUPAC Name: N-[[[4-(pentanoylamino)benzoyl]amino]carbamothioyl]cyclohexanecarboxamide Traditional Name: N-[[[4-(valerylamino)benzoyl]amino]thiocarbamoyl]cyclohexanecarboxamide Formula: C20H28N4O3S MolecularWeight: 404.52632

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)NC1=CC=C(C=C1)C(=O)NNC(=S)NC(=O)C2CCCCC2

Isomeric SMILES

CCCCC(=O)NC1=CC=C(C=C1)C(=O)NNC(=S)NC(=O)C2CCCCC2

InChI

InChI=1S/C20H28N4O3S/c1-2-3-9-17(25)21-16-12-10-15(11-13-16)19(27)23-24-20(28)22-18(26)14-7-5-4-6-8-14/h10-14H,2-9H2,1H3,(H,21,25)(H,23,27)(H2,22,24,26,28)