5-methyl-7-(2-methylpropyl)-2-(naphthalen-1-ylmethyl)-3-(3-oxidanylpropylsulfonyl)thieno[2,3-d]pyridazin-4-one

Systemtic Name: 5-methyl-7-(2-methylpropyl)-2-(naphthalen-1-ylmethyl)-3-(3-oxidanylpropylsulfonyl)thieno[2,3-d]pyridazin-4-one Openeye Name: 3-(3-hydroxypropylsulfonyl)-7-isobutyl-5-methyl-2-(1-naphthylmethyl)thieno[2,3-d]pyridazin-4-one CAS Name: 3-(3-hydroxypropylsulfonyl)-5-methyl-7-(2-methylpropyl)-2-(1-naphthalenylmethyl)-4-thieno[2,3-d]pyridazinone IUPAC Name: 3-(3-hydroxypropylsulfonyl)-5-methyl-7-(2-methylpropyl)-2-(naphthalen-1-ylmethyl)thieno[2,3-d]pyridazin-4-one Traditional Name: 3-(3-hydroxypropylsulfonyl)-7-isobutyl-5-methyl-2-(1-naphthylmethyl)thieno[2,3-d]pyridazin-4-one Formula: C25H28N2O4S2 MolecularWeight: 484.63082

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=NN(C(=O)C2=C1SC(=C2S(=O)(=O)CCCO)CC3=CC=CC4=CC=CC=C43)C

Isomeric SMILES

CC(C)CC1=NN(C(=O)C2=C1SC(=C2S(=O)(=O)CCCO)CC3=CC=CC4=CC=CC=C43)C

InChI

InChI=1S/C25H28N2O4S2/c1-16(2)14-20-23-22(25(29)27(3)26-20)24(33(30,31)13-7-12-28)21(32-23)15-18-10-6-9-17-8-4-5-11-19(17)18/h4-6,8-11,16,28H,7,12-15H2,1-3H3