1-methyl-3-[4-methyl-1,1-bis(oxidanylidene)thiolan-3-yl]-1-octadecyl-thiourea

Systemtic Name: 1-methyl-3-[4-methyl-1,1-bis(oxidanylidene)thiolan-3-yl]-1-octadecyl-thiourea Openeye Name: 1-methyl-3-(4-methyl-1,1-dioxo-thiolan-3-yl)-1-octadecyl-thiourea CAS Name: 1-methyl-3-(4-methyl-1,1-dioxo-3-thiolanyl)-1-octadecylthiourea IUPAC Name: 1-methyl-3-(4-methyl-1,1-dioxothiolan-3-yl)-1-octadecylthiourea Traditional Name: 3-(1,1-diketo-4-methyl-thiolan-3-yl)-1-methyl-1-stearyl-thiourea Formula: C25H50N2O2S2 MolecularWeight: 474.8067

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCN(C)C(=S)NC1CS(=O)(=O)CC1C

Isomeric SMILES

CCCCCCCCCCCCCCCCCCN(C)C(=S)NC1CS(=O)(=O)CC1C

InChI

InChI=1S/C25H50N2O2S2/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-27(3)25(30)26-24-22-31(28,29)21-23(24)2/h23-24H,4-22H2,1-3H3,(H,26,30)