ethyl 1-[2-(2,4-dimethyl-5-phenyl-imidazo[1,5-b]pyridazin-7-yl)sulfanylethanoyl]piperidine-4-carboxylate

Systemtic Name: ethyl 1-[2-(2,4-dimethyl-5-phenyl-imidazo[1,5-b]pyridazin-7-yl)sulfanylethanoyl]piperidine-4-carboxylate Openeye Name: ethyl 1-[2-(2,4-dimethyl-5-phenyl-imidazo[1,5-b]pyridazin-7-yl)sulfanylacetyl]piperidine-4-carboxylate CAS Name: 1-[2-[(2,4-dimethyl-5-phenyl-7-imidazo[1,5-b]pyridazinyl)thio]-1-oxoethyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[2-(2,4-dimethyl-5-phenylimidazo[1,5-b]pyridazin-7-yl)sulfanylacetyl]piperidine-4-carboxylate Traditional Name: 1-[2-[(2,4-dimethyl-5-phenyl-imidazo[1,5-b]pyridazin-7-yl)thio]acetyl]isonipecotic acid ethyl ester Formula: C24H28N4O3S MolecularWeight: 452.56912

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C(=O)CSC2=NC(=C3N2N=C(C=C3C)C)C4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C(=O)CSC2=NC(=C3N2N=C(C=C3C)C)C4=CC=CC=C4

InChI

InChI=1S/C24H28N4O3S/c1-4-31-23(30)19-10-12-27(13-11-19)20(29)15-32-24-25-21(18-8-6-5-7-9-18)22-16(2)14-17(3)26-28(22)24/h5-9,14,19H,4,10-13,15H2,1-3H3