propyl 4-[3-(3-oxidanylidene-1,4-benzothiazin-4-yl)propanoylamino]benzoate

Systemtic Name: propyl 4-[3-(3-oxidanylidene-1,4-benzothiazin-4-yl)propanoylamino]benzoate Openeye Name: propyl 4-[3-(3-oxo-1,4-benzothiazin-4-yl)propanoylamino]benzoate CAS Name: 4-[[1-oxo-3-(3-oxo-1,4-benzothiazin-4-yl)propyl]amino]benzoic acid propyl ester IUPAC Name: propyl 4-[3-(3-oxo-1,4-benzothiazin-4-yl)propanoylamino]benzoate Traditional Name: 4-[3-(3-keto-1,4-benzothiazin-4-yl)propanoylamino]benzoic acid propyl ester Formula: C21H22N2O4S MolecularWeight: 398.47538

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C1=CC=C(C=C1)NC(=O)CCN2C(=O)CSC3=CC=CC=C32

Isomeric SMILES

CCCOC(=O)C1=CC=C(C=C1)NC(=O)CCN2C(=O)CSC3=CC=CC=C32

InChI

InChI=1S/C21H22N2O4S/c1-2-13-27-21(26)15-7-9-16(10-8-15)22-19(24)11-12-23-17-5-3-4-6-18(17)28-14-20(23)25/h3-10H,2,11-14H2,1H3,(H,22,24)