2-(3-cyano-4,5,6-trimethyl-pyridin-2-yl)sulfanyl-N,N-bis(phenylmethyl)ethanamide

Systemtic Name: 2-(3-cyano-4,5,6-trimethyl-pyridin-2-yl)sulfanyl-N,N-bis(phenylmethyl)ethanamide Openeye Name: N,N-dibenzyl-2-[(3-cyano-4,5,6-trimethyl-2-pyridyl)sulfanyl]acetamide CAS Name: 2-[(3-cyano-4,5,6-trimethyl-2-pyridinyl)thio]-N,N-bis(phenylmethyl)acetamide IUPAC Name: N,N-dibenzyl-2-(3-cyano-4,5,6-trimethylpyridin-2-yl)sulfanylacetamide Traditional Name: N,N-dibenzyl-2-[(3-cyano-4,5,6-trimethyl-2-pyridyl)thio]acetamide Formula: C25H25N3OS MolecularWeight: 415.5505

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(C(=C1C)C#N)SCC(=O)N(CC2=CC=CC=C2)CC3=CC=CC=C3)C

Isomeric SMILES

CC1=C(N=C(C(=C1C)C#N)SCC(=O)N(CC2=CC=CC=C2)CC3=CC=CC=C3)C

InChI

InChI=1S/C25H25N3OS/c1-18-19(2)23(14-26)25(27-20(18)3)30-17-24(29)28(15-21-10-6-4-7-11-21)16-22-12-8-5-9-13-22/h4-13H,15-17H2,1-3H3