N-[4-[(pentanoylcarbamothioylamino)carbamoyl]phenyl]benzamide

Systemtic Name: N-[4-[(pentanoylcarbamothioylamino)carbamoyl]phenyl]benzamide Openeye Name: N-[4-[(pentanoylcarbamothioylamino)carbamoyl]phenyl]benzamide CAS Name: N-[4-[oxo-[[(1-oxopentylamino)-sulfanylidenemethyl]hydrazo]methyl]phenyl]benzamide IUPAC Name: N-[4-[(pentanoylcarbamothioylamino)carbamoyl]phenyl]benzamide Traditional Name: N-[4-[(valerylthiocarbamoylamino)carbamoyl]phenyl]benzamide Formula: C20H22N4O3S MolecularWeight: 398.47868

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)NC(=S)NNC(=O)C1=CC=C(C=C1)NC(=O)C2=CC=CC=C2

Isomeric SMILES

CCCCC(=O)NC(=S)NNC(=O)C1=CC=C(C=C1)NC(=O)C2=CC=CC=C2

InChI

InChI=1S/C20H22N4O3S/c1-2-3-9-17(25)22-20(28)24-23-19(27)15-10-12-16(13-11-15)21-18(26)14-7-5-4-6-8-14/h4-8,10-13H,2-3,9H2,1H3,(H,21,26)(H,23,27)(H2,22,24,25,28)