N-cyclooctyl-2-[2-[[2-(4-ethanoylphenyl)imino-1,3-thiazinan-3-yl]carbonyl]phenyl]sulfanyl-ethanamide

Systemtic Name: N-cyclooctyl-2-[2-[[2-(4-ethanoylphenyl)imino-1,3-thiazinan-3-yl]carbonyl]phenyl]sulfanyl-ethanamide Openeye Name: 2-[2-[2-(4-acetylphenyl)imino-1,3-thiazinane-3-carbonyl]phenyl]sulfanyl-N-cyclooctyl-acetamide CAS Name: 2-[[2-[[2-(4-acetylphenyl)imino-1,3-thiazinan-3-yl]-oxomethyl]phenyl]thio]-N-cyclooctylacetamide IUPAC Name: 2-[2-[2-(4-acetylphenyl)imino-1,3-thiazinane-3-carbonyl]phenyl]sulfanyl-N-cyclooctylacetamide Traditional Name: 2-[[2-[2-(4-acetylphenyl)imino-1,3-thiazinane-3-carbonyl]phenyl]thio]-N-cyclooctyl-acetamide Formula: C29H35N3O3S2 MolecularWeight: 537.7365

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)N=C2N(CCCS2)C(=O)C3=CC=CC=C3SCC(=O)NC4CCCCCCC4

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)N=C2N(CCCS2)C(=O)C3=CC=CC=C3SCC(=O)NC4CCCCCCC4

InChI

InChI=1S/C29H35N3O3S2/c1-21(33)22-14-16-24(17-15-22)31-29-32(18-9-19-36-29)28(35)25-12-7-8-13-26(25)37-20-27(34)30-23-10-5-3-2-4-6-11-23/h7-8,12-17,23H,2-6,9-11,18-20H2,1H3,(H,30,34)