2-[(5,6-diphenyl-1,2,4-triazin-3-yl)sulfanyl]-1-(2-ethylpiperidin-1-yl)ethanone

Systemtic Name: 2-[(5,6-diphenyl-1,2,4-triazin-3-yl)sulfanyl]-1-(2-ethylpiperidin-1-yl)ethanone Openeye Name: 2-[(5,6-diphenyl-1,2,4-triazin-3-yl)sulfanyl]-1-(2-ethyl-1-piperidyl)ethanone CAS Name: 2-[(5,6-diphenyl-1,2,4-triazin-3-yl)thio]-1-(2-ethyl-1-piperidinyl)ethanone IUPAC Name: 2-[(5,6-diphenyl-1,2,4-triazin-3-yl)sulfanyl]-1-(2-ethylpiperidin-1-yl)ethanone Traditional Name: 2-[(5,6-diphenyl-1,2,4-triazin-3-yl)thio]-1-(2-ethylpiperidino)ethanone Formula: C24H26N4OS MolecularWeight: 418.55444

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCCCN1C(=O)CSC2=NC(=C(N=N2)C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CCC1CCCCN1C(=O)CSC2=NC(=C(N=N2)C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C24H26N4OS/c1-2-20-15-9-10-16-28(20)21(29)17-30-24-25-22(18-11-5-3-6-12-18)23(26-27-24)19-13-7-4-8-14-19/h3-8,11-14,20H,2,9-10,15-17H2,1H3