2-[2-(3,3-diphenylpropylamino)-2-oxidanylidene-ethyl]sulfanyl-4,5,6-trimethyl-pyridine-3-carboxamide

Systemtic Name: 2-[2-(3,3-diphenylpropylamino)-2-oxidanylidene-ethyl]sulfanyl-4,5,6-trimethyl-pyridine-3-carboxamide Openeye Name: 2-[2-(3,3-diphenylpropylamino)-2-oxo-ethyl]sulfanyl-4,5,6-trimethyl-pyridine-3-carboxamide CAS Name: 2-[[2-(3,3-diphenylpropylamino)-2-oxoethyl]thio]-4,5,6-trimethyl-3-pyridinecarboxamide IUPAC Name: 2-[2-(3,3-diphenylpropylamino)-2-oxoethyl]sulfanyl-4,5,6-trimethylpyridine-3-carboxamide Traditional Name: 2-[[2-(3,3-diphenylpropylamino)-2-keto-ethyl]thio]-4,5,6-trimethyl-nicotinamide Formula: C26H29N3O2S MolecularWeight: 447.59236

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(C(=C1C)C(=O)N)SCC(=O)NCCC(C2=CC=CC=C2)C3=CC=CC=C3)C

Isomeric SMILES

CC1=C(N=C(C(=C1C)C(=O)N)SCC(=O)NCCC(C2=CC=CC=C2)C3=CC=CC=C3)C

InChI

InChI=1S/C26H29N3O2S/c1-17-18(2)24(25(27)31)26(29-19(17)3)32-16-23(30)28-15-14-22(20-10-6-4-7-11-20)21-12-8-5-9-13-21/h4-13,22H,14-16H2,1-3H3,(H2,27,31)(H,28,30)