5-bromanyl-N-(6-ethoxy-1,3-benzothiazol-2-yl)-2-methylsulfanyl-pyrimidine-4-carboxamide

Systemtic Name: 5-bromanyl-N-(6-ethoxy-1,3-benzothiazol-2-yl)-2-methylsulfanyl-pyrimidine-4-carboxamide Openeye Name: 5-bromo-N-(6-ethoxy-1,3-benzothiazol-2-yl)-2-methylsulfanyl-pyrimidine-4-carboxamide CAS Name: 5-bromo-N-(6-ethoxy-1,3-benzothiazol-2-yl)-2-(methylthio)-4-pyrimidinecarboxamide IUPAC Name: 5-bromo-N-(6-ethoxy-1,3-benzothiazol-2-yl)-2-methylsulfanylpyrimidine-4-carboxamide Traditional Name: 5-bromo-N-(6-ethoxy-1,3-benzothiazol-2-yl)-2-(methylthio)pyrimidine-4-carboxamide Formula: C15H13BrN4O2S2 MolecularWeight: 425.32332

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)N=C(S2)NC(=O)C3=NC(=NC=C3Br)SC

Isomeric SMILES

CCOC1=CC2=C(C=C1)N=C(S2)NC(=O)C3=NC(=NC=C3Br)SC

InChI

InChI=1S/C15H13BrN4O2S2/c1-3-22-8-4-5-10-11(6-8)24-15(18-10)20-13(21)12-9(16)7-17-14(19-12)23-2/h4-7H,3H2,1-2H3,(H,18,20,21)