ethyl 4-[(2-methyl-3-oxidanylidene-4H-1,4-benzothiazin-6-yl)carbonyl]thiomorpholine-3-carboxylate

Systemtic Name: ethyl 4-[(2-methyl-3-oxidanylidene-4H-1,4-benzothiazin-6-yl)carbonyl]thiomorpholine-3-carboxylate Openeye Name: ethyl 4-(2-methyl-3-oxo-4H-1,4-benzothiazine-6-carbonyl)thiomorpholine-3-carboxylate CAS Name: 4-[(2-methyl-3-oxo-4H-1,4-benzothiazin-6-yl)-oxomethyl]-3-thiomorpholinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(2-methyl-3-oxo-4H-1,4-benzothiazine-6-carbonyl)thiomorpholine-3-carboxylate Traditional Name: 4-(3-keto-2-methyl-4H-1,4-benzothiazine-6-carbonyl)thiomorpholine-3-carboxylic acid ethyl ester Formula: C17H20N2O4S2 MolecularWeight: 380.4817

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CSCCN1C(=O)C2=CC3=C(C=C2)SC(C(=O)N3)C

Isomeric SMILES

CCOC(=O)C1CSCCN1C(=O)C2=CC3=C(C=C2)SC(C(=O)N3)C

InChI

InChI=1S/C17H20N2O4S2/c1-3-23-17(22)13-9-24-7-6-19(13)16(21)11-4-5-14-12(8-11)18-15(20)10(2)25-14/h4-5,8,10,13H,3,6-7,9H2,1-2H3,(H,18,20)