N-[1,1-bis(oxidanylidene)thiolan-3-yl]-2-[2-(cyclooctylamino)-2-oxidanylidene-ethyl]sulfanyl-benzamide

Systemtic Name: N-[1,1-bis(oxidanylidene)thiolan-3-yl]-2-[2-(cyclooctylamino)-2-oxidanylidene-ethyl]sulfanyl-benzamide Openeye Name: 2-[2-(cyclooctylamino)-2-oxo-ethyl]sulfanyl-N-(1,1-dioxothiolan-3-yl)benzamide CAS Name: 2-[[2-(cyclooctylamino)-2-oxoethyl]thio]-N-(1,1-dioxo-3-thiolanyl)benzamide IUPAC Name: 2-[2-(cyclooctylamino)-2-oxoethyl]sulfanyl-N-(1,1-dioxothiolan-3-yl)benzamide Traditional Name: 2-[[2-(cyclooctylamino)-2-keto-ethyl]thio]-N-(1,1-diketothiolan-3-yl)benzamide Formula: C21H30N2O4S2 MolecularWeight: 438.6039

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CCC1)NC(=O)CSC2=CC=CC=C2C(=O)NC3CCS(=O)(=O)C3

Isomeric SMILES

C1CCCC(CCC1)NC(=O)CSC2=CC=CC=C2C(=O)NC3CCS(=O)(=O)C3

InChI

InChI=1S/C21H30N2O4S2/c24-20(22-16-8-4-2-1-3-5-9-16)14-28-19-11-7-6-10-18(19)21(25)23-17-12-13-29(26,27)15-17/h6-7,10-11,16-17H,1-5,8-9,12-15H2,(H,22,24)(H,23,25)