3-[2-[1-[(5-methyl-1,2-oxazol-3-yl)amino]-1-oxidanylidene-propan-2-yl]sulfanylethanoylamino]benzamide

Systemtic Name: 3-[2-[1-[(5-methyl-1,2-oxazol-3-yl)amino]-1-oxidanylidene-propan-2-yl]sulfanylethanoylamino]benzamide Openeye Name: 3-[[2-[1-methyl-2-[(5-methylisoxazol-3-yl)amino]-2-oxo-ethyl]sulfanylacetyl]amino]benzamide CAS Name: 3-[[2-[[1-[(5-methyl-3-isoxazolyl)amino]-1-oxopropan-2-yl]thio]-1-oxoethyl]amino]benzamide IUPAC Name: 3-[[2-[1-[(5-methyl-1,2-oxazol-3-yl)amino]-1-oxopropan-2-yl]sulfanylacetyl]amino]benzamide Traditional Name: 3-[[2-[[2-keto-1-methyl-2-[(5-methylisoxazol-3-yl)amino]ethyl]thio]acetyl]amino]benzamide Formula: C16H18N4O4S MolecularWeight: 362.40352

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)NC(=O)C(C)SCC(=O)NC2=CC=CC(=C2)C(=O)N

Isomeric SMILES

CC1=CC(=NO1)NC(=O)C(C)SCC(=O)NC2=CC=CC(=C2)C(=O)N

InChI

InChI=1S/C16H18N4O4S/c1-9-6-13(20-24-9)19-16(23)10(2)25-8-14(21)18-12-5-3-4-11(7-12)15(17)22/h3-7,10H,8H2,1-2H3,(H2,17,22)(H,18,21)(H,19,20,23)