2-(1,3-benzothiazol-2-ylsulfanyl)-N-pyrimidin-2-yl-ethanamide

Systemtic Name: 2-(1,3-benzothiazol-2-ylsulfanyl)-N-pyrimidin-2-yl-ethanamide Openeye Name: 2-(1,3-benzothiazol-2-ylsulfanyl)-N-pyrimidin-2-yl-acetamide CAS Name: 2-(1,3-benzothiazol-2-ylthio)-N-(2-pyrimidinyl)acetamide IUPAC Name: 2-(1,3-benzothiazol-2-ylsulfanyl)-N-pyrimidin-2-ylacetamide Traditional Name: 2-(1,3-benzothiazol-2-ylthio)-N-(2-pyrimidyl)acetamide Formula: C13H10N4OS2 MolecularWeight: 302.3747

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)SCC(=O)NC3=NC=CC=N3

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)SCC(=O)NC3=NC=CC=N3

InChI

InChI=1S/C13H10N4OS2/c18-11(17-12-14-6-3-7-15-12)8-19-13-16-9-4-1-2-5-10(9)20-13/h1-7H,8H2,(H,14,15,17,18)