[4-[6-(2-methylphenyl)pyridazin-3-yl]piperazin-1-yl]-(4-pyrrolidin-1-ylsulfonylphenyl)methanone

Systemtic Name: [4-[6-(2-methylphenyl)pyridazin-3-yl]piperazin-1-yl]-(4-pyrrolidin-1-ylsulfonylphenyl)methanone Openeye Name: [4-[6-(o-tolyl)pyridazin-3-yl]piperazin-1-yl]-(4-pyrrolidin-1-ylsulfonylphenyl)methanone CAS Name: [4-[6-(2-methylphenyl)-3-pyridazinyl]-1-piperazinyl]-[4-(1-pyrrolidinylsulfonyl)phenyl]methanone IUPAC Name: [4-[6-(2-methylphenyl)pyridazin-3-yl]piperazin-1-yl]-(4-pyrrolidin-1-ylsulfonylphenyl)methanone Traditional Name: [4-[6-(o-tolyl)pyridazin-3-yl]piperazino]-(4-pyrrolidinosulfonylphenyl)methanone Formula: C26H29N5O3S MolecularWeight: 491.60516

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2=NN=C(C=C2)N3CCN(CC3)C(=O)C4=CC=C(C=C4)S(=O)(=O)N5CCCC5

Isomeric SMILES

CC1=CC=CC=C1C2=NN=C(C=C2)N3CCN(CC3)C(=O)C4=CC=C(C=C4)S(=O)(=O)N5CCCC5

InChI

InChI=1S/C26H29N5O3S/c1-20-6-2-3-7-23(20)24-12-13-25(28-27-24)29-16-18-30(19-17-29)26(32)21-8-10-22(11-9-21)35(33,34)31-14-4-5-15-31/h2-3,6-13H,4-5,14-19H2,1H3