N-[4-[(propanoylcarbamothioylamino)carbamoyl]phenyl]pentanamide

Systemtic Name: N-[4-[(propanoylcarbamothioylamino)carbamoyl]phenyl]pentanamide Openeye Name: N-[4-[(propanoylcarbamothioylamino)carbamoyl]phenyl]pentanamide CAS Name: N-[4-[oxo-[[(1-oxopropylamino)-sulfanylidenemethyl]hydrazo]methyl]phenyl]pentanamide IUPAC Name: N-[4-[(propanoylcarbamothioylamino)carbamoyl]phenyl]pentanamide Traditional Name: N-[4-[(propionylthiocarbamoylamino)carbamoyl]phenyl]valeramide Formula: C16H22N4O3S MolecularWeight: 350.43588

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H22N4O3S/c1-3-5-6-14(22)17-12-9-7-11(8-10-12)15(23)19-20-16(24)18-13(21)4-2/h7-10H,3-6H2,1-2H3,(H,17,22)(H,19,23)(H2,18,20,21,24)