3-methyl-N-[4-[(propanoylcarbamothioylamino)carbamoyl]phenyl]butanamide

Systemtic Name: 3-methyl-N-[4-[(propanoylcarbamothioylamino)carbamoyl]phenyl]butanamide Openeye Name: 3-methyl-N-[4-[(propanoylcarbamothioylamino)carbamoyl]phenyl]butanamide CAS Name: 3-methyl-N-[4-[oxo-[[(1-oxopropylamino)-sulfanylidenemethyl]hydrazo]methyl]phenyl]butanamide IUPAC Name: 3-methyl-N-[4-[(propanoylcarbamothioylamino)carbamoyl]phenyl]butanamide Traditional Name: 3-methyl-N-[4-[(propionylthiocarbamoylamino)carbamoyl]phenyl]butyramide Formula: C16H22N4O3S MolecularWeight: 350.43588

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC(=S)NNC(=O)C1=CC=C(C=C1)NC(=O)CC(C)C

Isomeric SMILES

CCC(=O)NC(=S)NNC(=O)C1=CC=C(C=C1)NC(=O)CC(C)C

InChI

InChI=1S/C16H22N4O3S/c1-4-13(21)18-16(24)20-19-15(23)11-5-7-12(8-6-11)17-14(22)9-10(2)3/h5-8,10H,4,9H2,1-3H3,(H,17,22)(H,19,23)(H2,18,20,21,24)