N-methyl-3-[3-(6-methyl-4-oxidanylidene-2-sulfanylidene-1H-pyrimidin-5-yl)propanoylamino]benzamide

Systemtic Name: N-methyl-3-[3-(6-methyl-4-oxidanylidene-2-sulfanylidene-1H-pyrimidin-5-yl)propanoylamino]benzamide Openeye Name: N-methyl-3-[3-(6-methyl-4-oxo-2-thioxo-1H-pyrimidin-5-yl)propanoylamino]benzamide CAS Name: N-methyl-3-[[3-(6-methyl-4-oxo-2-sulfanylidene-1H-pyrimidin-5-yl)-1-oxopropyl]amino]benzamide IUPAC Name: N-methyl-3-[3-(6-methyl-4-oxo-2-sulfanylidene-1H-pyrimidin-5-yl)propanoylamino]benzamide Traditional Name: 3-[3-(4-keto-6-methyl-2-thioxo-1H-pyrimidin-5-yl)propanoylamino]-N-methyl-benzamide Formula: C16H18N4O3S MolecularWeight: 346.40412

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)NC(=S)N1)CCC(=O)NC2=CC=CC(=C2)C(=O)NC

Isomeric SMILES

CC1=C(C(=O)NC(=S)N1)CCC(=O)NC2=CC=CC(=C2)C(=O)NC

InChI

InChI=1S/C16H18N4O3S/c1-9-12(15(23)20-16(24)18-9)6-7-13(21)19-11-5-3-4-10(8-11)14(22)17-2/h3-5,8H,6-7H2,1-2H3,(H,17,22)(H,19,21)(H2,18,20,23,24)