2-(5-azanylidene-6-methyl-3,4-diphenyl-pyrimido[4,5-c]pyridazin-7-yl)sulfanyl-1-thiophen-2-yl-ethanone

Systemtic Name: 2-(5-azanylidene-6-methyl-3,4-diphenyl-pyrimido[4,5-c]pyridazin-7-yl)sulfanyl-1-thiophen-2-yl-ethanone Openeye Name: 2-(5-imino-6-methyl-3,4-diphenyl-pyrimido[4,5-c]pyridazin-7-yl)sulfanyl-1-(2-thienyl)ethanone CAS Name: 2-[(5-imino-6-methyl-3,4-diphenyl-7-pyrimido[4,5-c]pyridazinyl)thio]-1-thiophen-2-ylethanone IUPAC Name: 2-(5-imino-6-methyl-3,4-diphenylpyrimido[4,5-c]pyridazin-7-yl)sulfanyl-1-thiophen-2-ylethanone Traditional Name: 2-[(5-imino-6-methyl-3,4-diphenyl-pyrimido[4,5-c]pyridazin-7-yl)thio]-1-(2-thienyl)ethanone Formula: C25H19N5OS2 MolecularWeight: 469.58126

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=N)C2=C(C(=NN=C2N=C1SCC(=O)C3=CC=CS3)C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CN1C(=N)C2=C(C(=NN=C2N=C1SCC(=O)C3=CC=CS3)C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C25H19N5OS2/c1-30-23(26)21-20(16-9-4-2-5-10-16)22(17-11-6-3-7-12-17)28-29-24(21)27-25(30)33-15-18(31)19-13-8-14-32-19/h2-14,26H,15H2,1H3