N-[4-[(2,2-dimethylpropanoylcarbamothioylamino)carbamoyl]phenyl]pentanamide

Systemtic Name: N-[4-[(2,2-dimethylpropanoylcarbamothioylamino)carbamoyl]phenyl]pentanamide Openeye Name: N-[4-[(2,2-dimethylpropanoylcarbamothioylamino)carbamoyl]phenyl]pentanamide CAS Name: N-[4-[[[[(2,2-dimethyl-1-oxopropyl)amino]-sulfanylidenemethyl]hydrazo]-oxomethyl]phenyl]pentanamide IUPAC Name: N-[4-[(2,2-dimethylpropanoylcarbamothioylamino)carbamoyl]phenyl]pentanamide Traditional Name: N-[4-[(pivaloylthiocarbamoylamino)carbamoyl]phenyl]valeramide Formula: C18H26N4O3S MolecularWeight: 378.48904

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H26N4O3S/c1-5-6-7-14(23)19-13-10-8-12(9-11-13)15(24)21-22-17(26)20-16(25)18(2,3)4/h8-11H,5-7H2,1-4H3,(H,19,23)(H,21,24)(H2,20,22,25,26)