N-(6-methoxy-1,3-benzothiazol-2-yl)-2-(6-methyl-5-morpholin-4-ylsulfonyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-3-yl)ethanamide

Systemtic Name: N-(6-methoxy-1,3-benzothiazol-2-yl)-2-(6-methyl-5-morpholin-4-ylsulfonyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-3-yl)ethanamide Openeye Name: N-(6-methoxy-1,3-benzothiazol-2-yl)-2-(6-methyl-5-morpholinosulfonyl-4-oxo-thieno[2,3-d]pyrimidin-3-yl)acetamide CAS Name: N-(6-methoxy-1,3-benzothiazol-2-yl)-2-[6-methyl-5-(4-morpholinylsulfonyl)-4-oxo-3-thieno[2,3-d]pyrimidinyl]acetamide IUPAC Name: N-(6-methoxy-1,3-benzothiazol-2-yl)-2-(6-methyl-5-morpholin-4-ylsulfonyl-4-oxothieno[2,3-d]pyrimidin-3-yl)acetamide Traditional Name: 2-(4-keto-6-methyl-5-morpholinosulfonyl-thieno[2,3-d]pyrimidin-3-yl)-N-(6-methoxy-1,3-benzothiazol-2-yl)acetamide Formula: C21H21N5O6S3 MolecularWeight: 535.61634

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(S1)N=CN(C2=O)CC(=O)NC3=NC4=C(S3)C=C(C=C4)OC)S(=O)(=O)N5CCOCC5

Isomeric SMILES

CC1=C(C2=C(S1)N=CN(C2=O)CC(=O)NC3=NC4=C(S3)C=C(C=C4)OC)S(=O)(=O)N5CCOCC5

InChI

InChI=1S/C21H21N5O6S3/c1-12-18(35(29,30)26-5-7-32-8-6-26)17-19(33-12)22-11-25(20(17)28)10-16(27)24-21-23-14-4-3-13(31-2)9-15(14)34-21/h3-4,9,11H,5-8,10H2,1-2H3,(H,23,24,27)