6-(4-methylsulfonylphenyl)-N-(1-pentan-3-ylpiperidin-4-yl)pyridazin-3-amine

Systemtic Name: 6-(4-methylsulfonylphenyl)-N-(1-pentan-3-ylpiperidin-4-yl)pyridazin-3-amine Openeye Name: N-[1-(1-ethylpropyl)-4-piperidyl]-6-(4-methylsulfonylphenyl)pyridazin-3-amine CAS Name: 6-(4-methylsulfonylphenyl)-N-(1-pentan-3-yl-4-piperidinyl)-3-pyridazinamine IUPAC Name: 6-(4-methylsulfonylphenyl)-N-(1-pentan-3-ylpiperidin-4-yl)pyridazin-3-amine Traditional Name: [1-(1-ethylpropyl)-4-piperidyl]-[6-(4-mesylphenyl)pyridazin-3-yl]amine Formula: C21H30N4O2S MolecularWeight: 402.5535

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)N1CCC(CC1)NC2=NN=C(C=C2)C3=CC=C(C=C3)S(=O)(=O)C

Isomeric SMILES

CCC(CC)N1CCC(CC1)NC2=NN=C(C=C2)C3=CC=C(C=C3)S(=O)(=O)C

InChI

InChI=1S/C21H30N4O2S/c1-4-18(5-2)25-14-12-17(13-15-25)22-21-11-10-20(23-24-21)16-6-8-19(9-7-16)28(3,26)27/h6-11,17-18H,4-5,12-15H2,1-3H3,(H,22,24)