2-(3-piperidin-1-ylquinoxalin-2-yl)sulfanyl-N-(2,4,6-trimethylphenyl)ethanamide

Systemtic Name: 2-(3-piperidin-1-ylquinoxalin-2-yl)sulfanyl-N-(2,4,6-trimethylphenyl)ethanamide Openeye Name: 2-[3-(1-piperidyl)quinoxalin-2-yl]sulfanyl-N-(2,4,6-trimethylphenyl)acetamide CAS Name: 2-[[3-(1-piperidinyl)-2-quinoxalinyl]thio]-N-(2,4,6-trimethylphenyl)acetamide IUPAC Name: 2-(3-piperidin-1-ylquinoxalin-2-yl)sulfanyl-N-(2,4,6-trimethylphenyl)acetamide Traditional Name: N-mesityl-2-[(3-piperidinoquinoxalin-2-yl)thio]acetamide Formula: C24H28N4OS MolecularWeight: 420.57032

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)NC(=O)CSC2=NC3=CC=CC=C3N=C2N4CCCCC4)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)NC(=O)CSC2=NC3=CC=CC=C3N=C2N4CCCCC4)C

InChI

InChI=1S/C24H28N4OS/c1-16-13-17(2)22(18(3)14-16)27-21(29)15-30-24-23(28-11-7-4-8-12-28)25-19-9-5-6-10-20(19)26-24/h5-6,9-10,13-14H,4,7-8,11-12,15H2,1-3H3,(H,27,29)