3-[4-[3-[(2R)-2-methylpyrrolidin-1-yl]propoxy]phenyl]-6-(phenylmethyl)sulfinyl-pyridazine

Systemtic Name: 3-[4-[3-[(2R)-2-methylpyrrolidin-1-yl]propoxy]phenyl]-6-(phenylmethyl)sulfinyl-pyridazine Openeye Name: 3-benzylsulfinyl-6-[4-[3-[(2R)-2-methylpyrrolidin-1-yl]propoxy]phenyl]pyridazine CAS Name: 3-[4-[3-[(2R)-2-methyl-1-pyrrolidinyl]propoxy]phenyl]-6-(phenylmethyl)sulfinylpyridazine IUPAC Name: 3-benzylsulfinyl-6-[4-[3-[(2R)-2-methylpyrrolidin-1-yl]propoxy]phenyl]pyridazine Traditional Name: 3-benzylsulfinyl-6-[4-[3-[(2R)-2-methylpyrrolidino]propoxy]phenyl]pyridazine Formula: C25H29N3O2S MolecularWeight: 435.58166

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN1CCCOC2=CC=C(C=C2)C3=NN=C(C=C3)S(=O)CC4=CC=CC=C4

Isomeric SMILES

C[C@@H]1CCCN1CCCOC2=CC=C(C=C2)C3=NN=C(C=C3)S(=O)CC4=CC=CC=C4

InChI

InChI=1S/C25H29N3O2S/c1-20-7-5-16-28(20)17-6-18-30-23-12-10-22(11-13-23)24-14-15-25(27-26-24)31(29)19-21-8-3-2-4-9-21/h2-4,8-15,20H,5-7,16-19H2,1H3/t20-,31?/m1/s1