methyl 4-[2-(2H-1,4-benzoxazin-3-ylsulfanyl)ethanoylamino]benzoate

Systemtic Name: methyl 4-[2-(2H-1,4-benzoxazin-3-ylsulfanyl)ethanoylamino]benzoate Openeye Name: methyl 4-[[2-(2H-1,4-benzoxazin-3-ylsulfanyl)acetyl]amino]benzoate CAS Name: 4-[[2-(2H-1,4-benzoxazin-3-ylthio)-1-oxoethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[[2-(2H-1,4-benzoxazin-3-ylsulfanyl)acetyl]amino]benzoate Traditional Name: 4-[[2-(2H-1,4-benzoxazin-3-ylthio)acetyl]amino]benzoic acid methyl ester Formula: C18H16N2O4S MolecularWeight: 356.39564

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)NC(=O)CSC2=NC3=CC=CC=C3OC2

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)NC(=O)CSC2=NC3=CC=CC=C3OC2

InChI

InChI=1S/C18H16N2O4S/c1-23-18(22)12-6-8-13(9-7-12)19-16(21)11-25-17-10-24-15-5-3-2-4-14(15)20-17/h2-9H,10-11H2,1H3,(H,19,21)