2-(1,3-benzoxazol-2-ylsulfanyl)-N-[4-[6-(4-methylpiperidin-1-yl)pyridazin-3-yl]phenyl]ethanamide

Systemtic Name: 2-(1,3-benzoxazol-2-ylsulfanyl)-N-[4-[6-(4-methylpiperidin-1-yl)pyridazin-3-yl]phenyl]ethanamide Openeye Name: 2-(1,3-benzoxazol-2-ylsulfanyl)-N-[4-[6-(4-methyl-1-piperidyl)pyridazin-3-yl]phenyl]acetamide CAS Name: 2-(1,3-benzoxazol-2-ylthio)-N-[4-[6-(4-methyl-1-piperidinyl)-3-pyridazinyl]phenyl]acetamide IUPAC Name: 2-(1,3-benzoxazol-2-ylsulfanyl)-N-[4-[6-(4-methylpiperidin-1-yl)pyridazin-3-yl]phenyl]acetamide Traditional Name: 2-(1,3-benzoxazol-2-ylthio)-N-[4-[6-(4-methylpiperidino)pyridazin-3-yl]phenyl]acetamide Formula: C25H25N5O2S MolecularWeight: 459.5633

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C2=NN=C(C=C2)C3=CC=C(C=C3)NC(=O)CSC4=NC5=CC=CC=C5O4

Isomeric SMILES

CC1CCN(CC1)C2=NN=C(C=C2)C3=CC=C(C=C3)NC(=O)CSC4=NC5=CC=CC=C5O4

InChI

InChI=1S/C25H25N5O2S/c1-17-12-14-30(15-13-17)23-11-10-20(28-29-23)18-6-8-19(9-7-18)26-24(31)16-33-25-27-21-4-2-3-5-22(21)32-25/h2-11,17H,12-16H2,1H3,(H,26,31)