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

Systemtic Name: N-(6-methoxy-1,3-benzothiazol-2-yl)-2-(6-methyl-4-oxidanylidene-5-piperidin-1-ylsulfonyl-thieno[2,3-d]pyrimidin-3-yl)ethanamide Openeye Name: N-(6-methoxy-1,3-benzothiazol-2-yl)-2-[6-methyl-4-oxo-5-(1-piperidylsulfonyl)thieno[2,3-d]pyrimidin-3-yl]acetamide CAS Name: N-(6-methoxy-1,3-benzothiazol-2-yl)-2-[6-methyl-4-oxo-5-(1-piperidinylsulfonyl)-3-thieno[2,3-d]pyrimidinyl]acetamide IUPAC Name: N-(6-methoxy-1,3-benzothiazol-2-yl)-2-(6-methyl-4-oxo-5-piperidin-1-ylsulfonylthieno[2,3-d]pyrimidin-3-yl)acetamide Traditional Name: 2-(4-keto-6-methyl-5-piperidinosulfonyl-thieno[2,3-d]pyrimidin-3-yl)-N-(6-methoxy-1,3-benzothiazol-2-yl)acetamide Formula: C22H23N5O5S3 MolecularWeight: 533.64352

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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)N5CCCCC5

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)N5CCCCC5

InChI

InChI=1S/C22H23N5O5S3/c1-13-19(35(30,31)27-8-4-3-5-9-27)18-20(33-13)23-12-26(21(18)29)11-17(28)25-22-24-15-7-6-14(32-2)10-16(15)34-22/h6-7,10,12H,3-5,8-9,11H2,1-2H3,(H,24,25,28)