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

Systemtic Name: methyl 3-[2-(4H-3,1-benzothiazin-2-ylsulfanyl)ethanoylamino]-4-methyl-benzoate Openeye Name: methyl 3-[[2-(4H-3,1-benzothiazin-2-ylsulfanyl)acetyl]amino]-4-methyl-benzoate CAS Name: 3-[[2-(4H-3,1-benzothiazin-2-ylthio)-1-oxoethyl]amino]-4-methylbenzoic acid methyl ester IUPAC Name: methyl 3-[[2-(4H-3,1-benzothiazin-2-ylsulfanyl)acetyl]amino]-4-methylbenzoate Traditional Name: 3-[[2-(4H-3,1-benzothiazin-2-ylthio)acetyl]amino]-4-methyl-benzoic acid methyl ester Formula: C19H18N2O3S2 MolecularWeight: 386.48782

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)OC)NC(=O)CSC2=NC3=CC=CC=C3CS2

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)OC)NC(=O)CSC2=NC3=CC=CC=C3CS2

InChI

InChI=1S/C19H18N2O3S2/c1-12-7-8-13(18(23)24-2)9-16(12)20-17(22)11-26-19-21-15-6-4-3-5-14(15)10-25-19/h3-9H,10-11H2,1-2H3,(H,20,22)