ethyl 4-[[4-(2,3-dihydro-1,4-benzothiazin-4-yl)-4-oxidanylidene-butanoyl]amino]benzoate

Systemtic Name: ethyl 4-[[4-(2,3-dihydro-1,4-benzothiazin-4-yl)-4-oxidanylidene-butanoyl]amino]benzoate Openeye Name: ethyl 4-[[4-(2,3-dihydro-1,4-benzothiazin-4-yl)-4-oxo-butanoyl]amino]benzoate CAS Name: 4-[[4-(2,3-dihydro-1,4-benzothiazin-4-yl)-1,4-dioxobutyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[4-(2,3-dihydro-1,4-benzothiazin-4-yl)-4-oxobutanoyl]amino]benzoate Traditional Name: 4-[[4-(2,3-dihydro-1,4-benzothiazin-4-yl)-4-keto-butanoyl]amino]benzoic acid ethyl ester Formula: C21H22N2O4S MolecularWeight: 398.47538

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=O)CCC(=O)N2CCSC3=CC=CC=C32

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=O)CCC(=O)N2CCSC3=CC=CC=C32

InChI

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