N-[4-[(octanoylcarbamothioylamino)carbamoyl]phenyl]cyclopropanecarboxamide

Systemtic Name: N-[4-[(octanoylcarbamothioylamino)carbamoyl]phenyl]cyclopropanecarboxamide Openeye Name: N-[4-[(octanoylcarbamothioylamino)carbamoyl]phenyl]cyclopropanecarboxamide CAS Name: N-[4-[oxo-[[(1-oxooctylamino)-sulfanylidenemethyl]hydrazo]methyl]phenyl]cyclopropanecarboxamide IUPAC Name: N-[4-[(octanoylcarbamothioylamino)carbamoyl]phenyl]cyclopropanecarboxamide Traditional Name: N-[4-[(caprylylthiocarbamoylamino)carbamoyl]phenyl]cyclopropanecarboxamide Formula: C20H28N4O3S MolecularWeight: 404.52632

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)NC(=S)NNC(=O)C1=CC=C(C=C1)NC(=O)C2CC2

Isomeric SMILES

CCCCCCCC(=O)NC(=S)NNC(=O)C1=CC=C(C=C1)NC(=O)C2CC2

InChI

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