ethyl 5-methyl-4,4-bis(oxidanylidene)-3-propan-2-ylsulfanyl-thieno[3,4-c][2,1]benzothiazine-1-carboxylate

Systemtic Name: ethyl 5-methyl-4,4-bis(oxidanylidene)-3-propan-2-ylsulfanyl-thieno[3,4-c][2,1]benzothiazine-1-carboxylate Openeye Name: ethyl 3-isopropylsulfanyl-5-methyl-4,4-dioxo-thieno[3,4-c][2,1]benzothiazine-1-carboxylate CAS Name: 5-methyl-4,4-dioxo-3-(propan-2-ylthio)-1-thieno[3,4-c][2,1]benzothiazinecarboxylic acid ethyl ester IUPAC Name: ethyl 5-methyl-4,4-dioxo-3-propan-2-ylsulfanylthieno[3,4-c][2,1]benzothiazine-1-carboxylate Traditional Name: 3-(isopropylthio)-4,4-diketo-5-methyl-thieno[3,4-c][2,1]benzothiazine-1-carboxylic acid ethyl ester Formula: C17H19NO4S3 MolecularWeight: 397.53206

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C2C3=CC=CC=C3N(S(=O)(=O)C2=C(S1)SC(C)C)C

Isomeric SMILES

CCOC(=O)C1=C2C3=CC=CC=C3N(S(=O)(=O)C2=C(S1)SC(C)C)C

InChI

InChI=1S/C17H19NO4S3/c1-5-22-16(19)14-13-11-8-6-7-9-12(11)18(4)25(20,21)15(13)17(24-14)23-10(2)3/h6-10H,5H2,1-4H3