N-[4-[(2-methylpropanoylcarbamothioylamino)carbamoyl]phenyl]pentanamide

Systemtic Name: N-[4-[(2-methylpropanoylcarbamothioylamino)carbamoyl]phenyl]pentanamide Openeye Name: N-[4-[(2-methylpropanoylcarbamothioylamino)carbamoyl]phenyl]pentanamide CAS Name: N-[4-[[[[(2-methyl-1-oxopropyl)amino]-sulfanylidenemethyl]hydrazo]-oxomethyl]phenyl]pentanamide IUPAC Name: N-[4-[(2-methylpropanoylcarbamothioylamino)carbamoyl]phenyl]pentanamide Traditional Name: N-[4-[(isobutyrylthiocarbamoylamino)carbamoyl]phenyl]valeramide Formula: C17H24N4O3S MolecularWeight: 364.46246

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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

Isomeric SMILES

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

InChI

InChI=1S/C17H24N4O3S/c1-4-5-6-14(22)18-13-9-7-12(8-10-13)16(24)20-21-17(25)19-15(23)11(2)3/h7-11H,4-6H2,1-3H3,(H,18,22)(H,20,24)(H2,19,21,23,25)