N-(6-methoxy-1,3-benzothiazol-2-yl)-2-pyrimidin-2-ylsulfanyl-butanamide

Systemtic Name: N-(6-methoxy-1,3-benzothiazol-2-yl)-2-pyrimidin-2-ylsulfanyl-butanamide Openeye Name: N-(6-methoxy-1,3-benzothiazol-2-yl)-2-pyrimidin-2-ylsulfanyl-butanamide CAS Name: N-(6-methoxy-1,3-benzothiazol-2-yl)-2-(2-pyrimidinylthio)butanamide IUPAC Name: N-(6-methoxy-1,3-benzothiazol-2-yl)-2-pyrimidin-2-ylsulfanylbutanamide Traditional Name: N-(6-methoxy-1,3-benzothiazol-2-yl)-2-(2-pyrimidylthio)butyramide Formula: C16H16N4O2S2 MolecularWeight: 360.45384

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=NC2=C(S1)C=C(C=C2)OC)SC3=NC=CC=N3

Isomeric SMILES

CCC(C(=O)NC1=NC2=C(S1)C=C(C=C2)OC)SC3=NC=CC=N3

InChI

InChI=1S/C16H16N4O2S2/c1-3-12(23-15-17-7-4-8-18-15)14(21)20-16-19-11-6-5-10(22-2)9-13(11)24-16/h4-9,12H,3H2,1-2H3,(H,19,20,21)