N-[3-[6-(azepan-1-yl)pyridazin-3-yl]phenyl]-2-cyclopentylsulfanyl-ethanamide

Systemtic Name: N-[3-[6-(azepan-1-yl)pyridazin-3-yl]phenyl]-2-cyclopentylsulfanyl-ethanamide Openeye Name: N-[3-[6-(azepan-1-yl)pyridazin-3-yl]phenyl]-2-cyclopentylsulfanyl-acetamide CAS Name: N-[3-[6-(1-azepanyl)-3-pyridazinyl]phenyl]-2-(cyclopentylthio)acetamide IUPAC Name: N-[3-[6-(azepan-1-yl)pyridazin-3-yl]phenyl]-2-cyclopentylsulfanylacetamide Traditional Name: N-[3-[6-(azepan-1-yl)pyridazin-3-yl]phenyl]-2-(cyclopentylthio)acetamide Formula: C23H30N4OS MolecularWeight: 410.5755

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C2=NN=C(C=C2)C3=CC(=CC=C3)NC(=O)CSC4CCCC4

Isomeric SMILES

C1CCCN(CC1)C2=NN=C(C=C2)C3=CC(=CC=C3)NC(=O)CSC4CCCC4

InChI

InChI=1S/C23H30N4OS/c28-23(17-29-20-10-3-4-11-20)24-19-9-7-8-18(16-19)21-12-13-22(26-25-21)27-14-5-1-2-6-15-27/h7-9,12-13,16,20H,1-6,10-11,14-15,17H2,(H,24,28)