(6E)-5-azanylidene-6-[(4-bromophenyl)methylidene]-2-pentan-3-yl-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one

Systemtic Name: (6E)-5-azanylidene-6-[(4-bromophenyl)methylidene]-2-pentan-3-yl-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one Openeye Name: (6E)-6-[(4-bromophenyl)methylene]-2-(1-ethylpropyl)-5-imino-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one CAS Name: (6E)-6-[(4-bromophenyl)methylidene]-5-imino-2-pentan-3-yl-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one IUPAC Name: (6E)-6-[(4-bromophenyl)methylidene]-5-imino-2-pentan-3-yl-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one Traditional Name: (6E)-6-(4-bromobenzylidene)-2-(1-ethylpropyl)-5-imino-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one Formula: C17H17BrN4OS MolecularWeight: 405.31208

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)C1=NN2C(=N)C(=CC3=CC=C(C=C3)Br)C(=O)N=C2S1

Isomeric SMILES

CCC(CC)C1=NN2C(=N)/C(=C\C3=CC=C(C=C3)Br)/C(=O)N=C2S1

InChI

InChI=1S/C17H17BrN4OS/c1-3-11(4-2)16-21-22-14(19)13(15(23)20-17(22)24-16)9-10-5-7-12(18)8-6-10/h5-9,11,19H,3-4H2,1-2H3/b13-9+,19-14?