2-[2-(cyclooctylamino)-2-oxidanylidene-ethyl]sulfanyl-N-(pyridin-2-ylmethyl)benzamide

Systemtic Name: 2-[2-(cyclooctylamino)-2-oxidanylidene-ethyl]sulfanyl-N-(pyridin-2-ylmethyl)benzamide Openeye Name: 2-[2-(cyclooctylamino)-2-oxo-ethyl]sulfanyl-N-(2-pyridylmethyl)benzamide CAS Name: 2-[[2-(cyclooctylamino)-2-oxoethyl]thio]-N-(2-pyridinylmethyl)benzamide IUPAC Name: 2-[2-(cyclooctylamino)-2-oxoethyl]sulfanyl-N-(pyridin-2-ylmethyl)benzamide Traditional Name: 2-[[2-(cyclooctylamino)-2-keto-ethyl]thio]-N-(2-pyridylmethyl)benzamide Formula: C23H29N3O2S MolecularWeight: 411.56026

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CCC1)NC(=O)CSC2=CC=CC=C2C(=O)NCC3=CC=CC=N3

Isomeric SMILES

C1CCCC(CCC1)NC(=O)CSC2=CC=CC=C2C(=O)NCC3=CC=CC=N3

InChI

InChI=1S/C23H29N3O2S/c27-22(26-18-10-4-2-1-3-5-11-18)17-29-21-14-7-6-13-20(21)23(28)25-16-19-12-8-9-15-24-19/h6-9,12-15,18H,1-5,10-11,16-17H2,(H,25,28)(H,26,27)