N-(5-chloranyl-2-methoxy-phenyl)-2-[[4,6-di(piperidin-1-yl)-1,3,5-triazin-2-yl]sulfanyl]ethanamide

Systemtic Name: N-(5-chloranyl-2-methoxy-phenyl)-2-[[4,6-di(piperidin-1-yl)-1,3,5-triazin-2-yl]sulfanyl]ethanamide Openeye Name: 2-[[4,6-bis(1-piperidyl)-1,3,5-triazin-2-yl]sulfanyl]-N-(5-chloro-2-methoxy-phenyl)acetamide CAS Name: 2-[[4,6-bis(1-piperidinyl)-1,3,5-triazin-2-yl]thio]-N-(5-chloro-2-methoxyphenyl)acetamide IUPAC Name: N-(5-chloro-2-methoxyphenyl)-2-[[4,6-di(piperidin-1-yl)-1,3,5-triazin-2-yl]sulfanyl]acetamide Traditional Name: N-(5-chloro-2-methoxy-phenyl)-2-[(4,6-dipiperidino-s-triazin-2-yl)thio]acetamide Formula: C22H29ClN6O2S MolecularWeight: 477.02266

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Cl)NC(=O)CSC2=NC(=NC(=N2)N3CCCCC3)N4CCCCC4

Isomeric SMILES

COC1=C(C=C(C=C1)Cl)NC(=O)CSC2=NC(=NC(=N2)N3CCCCC3)N4CCCCC4

InChI

InChI=1S/C22H29ClN6O2S/c1-31-18-9-8-16(23)14-17(18)24-19(30)15-32-22-26-20(28-10-4-2-5-11-28)25-21(27-22)29-12-6-3-7-13-29/h8-9,14H,2-7,10-13,15H2,1H3,(H,24,30)