2,7-bis(5-methylhexan-3-yl)-3,6-dihydro-1,2,7-thiadiazepine 1,1-dioxide

Systemtic Name: 2,7-bis(5-methylhexan-3-yl)-3,6-dihydro-1,2,7-thiadiazepine 1,1-dioxide Openeye Name: 2,7-bis(1-ethyl-3-methyl-butyl)-3,6-dihydro-1,2,7-thiadiazepine 1,1-dioxide CAS Name: 2,7-bis(5-methylhexan-3-yl)-3,6-dihydro-1,2,7-thiadiazepine 1,1-dioxide IUPAC Name: 2,7-bis(5-methylhexan-3-yl)-3,6-dihydro-1,2,7-thiadiazepine 1,1-dioxide Traditional Name: 2,7-bis(1-ethyl-3-methyl-butyl)-3,6-dihydro-1,2,7-thiadiazepine 1,1-dioxide Formula: C18H36N2O2S MolecularWeight: 344.55564

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(CC(C)C)N1CC=CCN(S1(=O)=O)C(CC)CC(C)C

Isomeric SMILES

CCC(CC(C)C)N1CC=CCN(S1(=O)=O)C(CC)CC(C)C

InChI

InChI=1S/C18H36N2O2S/c1-7-17(13-15(3)4)19-11-9-10-12-20(23(19,21)22)18(8-2)14-16(5)6/h9-10,15-18H,7-8,11-14H2,1-6H3