N-[[(4-methoxyphenyl)carbonylamino]carbamothioyl]-3-methyl-butanamide

Systemtic Name: N-[[(4-methoxyphenyl)carbonylamino]carbamothioyl]-3-methyl-butanamide Openeye Name: N-[[(4-methoxybenzoyl)amino]carbamothioyl]-3-methyl-butanamide CAS Name: N-[[[(4-methoxyphenyl)-oxomethyl]hydrazo]-sulfanylidenemethyl]-3-methylbutanamide IUPAC Name: N-[[(4-methoxybenzoyl)amino]carbamothioyl]-3-methylbutanamide Traditional Name: 3-methyl-N-[(p-anisoylamino)thiocarbamoyl]butyramide Formula: C14H19N3O3S MolecularWeight: 309.38396

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H19N3O3S/c1-9(2)8-12(18)15-14(21)17-16-13(19)10-4-6-11(20-3)7-5-10/h4-7,9H,8H2,1-3H3,(H,16,19)(H2,15,17,18,21)