N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-2-thieno[2,3-d]pyrimidin-4-ylsulfanyl-ethanamide

Systemtic Name: N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-2-thieno[2,3-d]pyrimidin-4-ylsulfanyl-ethanamide Openeye Name: N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-2-thieno[2,3-d]pyrimidin-4-ylsulfanyl-acetamide CAS Name: N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-2-(4-thieno[2,3-d]pyrimidinylthio)acetamide IUPAC Name: N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-2-thieno[2,3-d]pyrimidin-4-ylsulfanylacetamide Traditional Name: N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-2-(thieno[2,3-d]pyrimidin-4-ylthio)acetamide Formula: C17H14N4OS3 MolecularWeight: 386.51426

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)SC(=N2)NC(=O)CSC3=NC=NC4=C3C=CS4)C

Isomeric SMILES

CC1=CC(=C2C(=C1)SC(=N2)NC(=O)CSC3=NC=NC4=C3C=CS4)C

InChI

InChI=1S/C17H14N4OS3/c1-9-5-10(2)14-12(6-9)25-17(21-14)20-13(22)7-24-16-11-3-4-23-15(11)18-8-19-16/h3-6,8H,7H2,1-2H3,(H,20,21,22)