1-(6-chloranylpyridazin-3-yl)-5,5-dimethyl-3-(thiophen-2-ylmethyl)-6,7-dihydroindazol-4-one

Systemtic Name: 1-(6-chloranylpyridazin-3-yl)-5,5-dimethyl-3-(thiophen-2-ylmethyl)-6,7-dihydroindazol-4-one Openeye Name: 1-(6-chloropyridazin-3-yl)-5,5-dimethyl-3-(2-thienylmethyl)-6,7-dihydroindazol-4-one CAS Name: 1-(6-chloro-3-pyridazinyl)-5,5-dimethyl-3-(thiophen-2-ylmethyl)-6,7-dihydroindazol-4-one IUPAC Name: 1-(6-chloropyridazin-3-yl)-5,5-dimethyl-3-(thiophen-2-ylmethyl)-6,7-dihydroindazol-4-one Traditional Name: 1-(6-chloropyridazin-3-yl)-5,5-dimethyl-3-(2-thenyl)-6,7-dihydroindazol-4-one Formula: C18H17ClN4OS MolecularWeight: 372.87178

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CCC2=C(C1=O)C(=NN2C3=NN=C(C=C3)Cl)CC4=CC=CS4)C

Isomeric SMILES

CC1(CCC2=C(C1=O)C(=NN2C3=NN=C(C=C3)Cl)CC4=CC=CS4)C

InChI

InChI=1S/C18H17ClN4OS/c1-18(2)8-7-13-16(17(18)24)12(10-11-4-3-9-25-11)22-23(13)15-6-5-14(19)20-21-15/h3-6,9H,7-8,10H2,1-2H3