dimethyl 6-methyl-2-thiophen-2-yl-5aH-pyrido[1,2-d][1,3,4]thiadiazepine-4,5-dicarboxylate

Systemtic Name: dimethyl 6-methyl-2-thiophen-2-yl-5aH-pyrido[1,2-d][1,3,4]thiadiazepine-4,5-dicarboxylate Openeye Name: dimethyl 6-methyl-2-(2-thienyl)-5aH-pyrido[1,2-d][1,3,4]thiadiazepine-4,5-dicarboxylate CAS Name: 6-methyl-2-thiophen-2-yl-5aH-pyrido[1,2-d][1,3,4]thiadiazepine-4,5-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 6-methyl-2-thiophen-2-yl-5aH-pyrido[1,2-d][1,3,4]thiadiazepine-4,5-dicarboxylate Traditional Name: 6-methyl-2-(2-thienyl)-5aH-pyrido[1,2-d][1,3,4]thiadiazepine-4,5-dicarboxylic acid dimethyl ester Formula: C17H16N2O4S2 MolecularWeight: 376.44994

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CN2C1C(=C(SC(=N2)C3=CC=CS3)C(=O)OC)C(=O)OC

Isomeric SMILES

CC1=CC=CN2C1C(=C(SC(=N2)C3=CC=CS3)C(=O)OC)C(=O)OC

InChI

InChI=1S/C17H16N2O4S2/c1-10-6-4-8-19-13(10)12(16(20)22-2)14(17(21)23-3)25-15(18-19)11-7-5-9-24-11/h4-9,13H,1-3H3