(2Z)-2-[(carbamothioylamino)methylidene]-N-(2-methylphenyl)-3-oxidanylidene-butanamide

Systemtic Name: (2Z)-2-[(carbamothioylamino)methylidene]-N-(2-methylphenyl)-3-oxidanylidene-butanamide Openeye Name: (2Z)-2-[(carbamothioylamino)methylene]-N-(o-tolyl)-3-oxo-butanamide CAS Name: (2Z)-2-[(carbamothioylamino)methylidene]-N-(2-methylphenyl)-3-oxobutanamide IUPAC Name: (2Z)-2-[(carbamothioylamino)methylidene]-N-(2-methylphenyl)-3-oxobutanamide Traditional Name: (Z)-2-acetyl-N-(o-tolyl)-3-thioureido-acrylamide Formula: C13H15N3O2S MolecularWeight: 277.3421

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(=O)C(=CNC(=S)N)C(=O)C

Isomeric SMILES

CC1=CC=CC=C1NC(=O)/C(=C\NC(=S)N)/C(=O)C

InChI

InChI=1S/C13H15N3O2S/c1-8-5-3-4-6-11(8)16-12(18)10(9(2)17)7-15-13(14)19/h3-7H,1-2H3,(H,16,18)(H3,14,15,19)/b10-7-