(3S)-3-(2,4-dimethyl-5-phenyl-imidazo[1,5-b]pyridazin-7-yl)sulfanyloxolan-2-one

Systemtic Name: (3S)-3-(2,4-dimethyl-5-phenyl-imidazo[1,5-b]pyridazin-7-yl)sulfanyloxolan-2-one Openeye Name: (3S)-3-(2,4-dimethyl-5-phenyl-imidazo[1,5-b]pyridazin-7-yl)sulfanyltetrahydrofuran-2-one CAS Name: (3S)-3-[(2,4-dimethyl-5-phenyl-7-imidazo[1,5-b]pyridazinyl)thio]-2-oxolanone IUPAC Name: (3S)-3-(2,4-dimethyl-5-phenylimidazo[1,5-b]pyridazin-7-yl)sulfanyloxolan-2-one Traditional Name: (3S)-3-[(2,4-dimethyl-5-phenyl-imidazo[1,5-b]pyridazin-7-yl)thio]tetrahydrofuran-2-one Formula: C18H17N3O2S MolecularWeight: 339.41148

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN2C1=C(N=C2SC3CCOC3=O)C4=CC=CC=C4)C

Isomeric SMILES

CC1=CC(=NN2C1=C(N=C2S[C@H]3CCOC3=O)C4=CC=CC=C4)C

InChI

InChI=1S/C18H17N3O2S/c1-11-10-12(2)20-21-16(11)15(13-6-4-3-5-7-13)19-18(21)24-14-8-9-23-17(14)22/h3-7,10,14H,8-9H2,1-2H3/t14-/m0/s1