N-(1,3-benzothiazol-2-yl)-2-(6-pyrrolidin-1-ylpyrimidin-4-yl)sulfanyl-ethanamide

Systemtic Name: N-(1,3-benzothiazol-2-yl)-2-(6-pyrrolidin-1-ylpyrimidin-4-yl)sulfanyl-ethanamide Openeye Name: N-(1,3-benzothiazol-2-yl)-2-(6-pyrrolidin-1-ylpyrimidin-4-yl)sulfanyl-acetamide CAS Name: N-(1,3-benzothiazol-2-yl)-2-[[6-(1-pyrrolidinyl)-4-pyrimidinyl]thio]acetamide IUPAC Name: N-(1,3-benzothiazol-2-yl)-2-(6-pyrrolidin-1-ylpyrimidin-4-yl)sulfanylacetamide Traditional Name: N-(1,3-benzothiazol-2-yl)-2-[(6-pyrrolidinopyrimidin-4-yl)thio]acetamide Formula: C17H17N5OS2 MolecularWeight: 371.47978

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=CC(=NC=N2)SCC(=O)NC3=NC4=CC=CC=C4S3

Isomeric SMILES

C1CCN(C1)C2=CC(=NC=N2)SCC(=O)NC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C17H17N5OS2/c23-15(21-17-20-12-5-1-2-6-13(12)25-17)10-24-16-9-14(18-11-19-16)22-7-3-4-8-22/h1-2,5-6,9,11H,3-4,7-8,10H2,(H,20,21,23)