2-[2-(cyclooctylamino)-2-oxidanylidene-ethyl]sulfanyl-N-[3-(2,2-dimethylpropanoylamino)phenyl]benzamide

Systemtic Name: 2-[2-(cyclooctylamino)-2-oxidanylidene-ethyl]sulfanyl-N-[3-(2,2-dimethylpropanoylamino)phenyl]benzamide Openeye Name: 2-[2-(cyclooctylamino)-2-oxo-ethyl]sulfanyl-N-[3-(2,2-dimethylpropanoylamino)phenyl]benzamide CAS Name: 2-[[2-(cyclooctylamino)-2-oxoethyl]thio]-N-[3-[(2,2-dimethyl-1-oxopropyl)amino]phenyl]benzamide IUPAC Name: 2-[2-(cyclooctylamino)-2-oxoethyl]sulfanyl-N-[3-(2,2-dimethylpropanoylamino)phenyl]benzamide Traditional Name: 2-[[2-(cyclooctylamino)-2-keto-ethyl]thio]-N-[3-(pivaloylamino)phenyl]benzamide Formula: C28H37N3O3S MolecularWeight: 495.67668

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)NC1=CC=CC(=C1)NC(=O)C2=CC=CC=C2SCC(=O)NC3CCCCCCC3

Isomeric SMILES

CC(C)(C)C(=O)NC1=CC=CC(=C1)NC(=O)C2=CC=CC=C2SCC(=O)NC3CCCCCCC3

InChI

InChI=1S/C28H37N3O3S/c1-28(2,3)27(34)31-22-15-11-14-21(18-22)30-26(33)23-16-9-10-17-24(23)35-19-25(32)29-20-12-7-5-4-6-8-13-20/h9-11,14-18,20H,4-8,12-13,19H2,1-3H3,(H,29,32)(H,30,33)(H,31,34)