1-butyl-3-(3-butyl-4-propyl-1,2-thiazol-5-yl)-5-pent-4-yn-2-yl-1,3,5-triazinan-2-one

Systemtic Name: 1-butyl-3-(3-butyl-4-propyl-1,2-thiazol-5-yl)-5-pent-4-yn-2-yl-1,3,5-triazinan-2-one Openeye Name: 1-butyl-3-(3-butyl-4-propyl-isothiazol-5-yl)-5-(1-methylbut-3-ynyl)-1,3,5-triazinan-2-one CAS Name: 1-butyl-3-(3-butyl-4-propyl-5-isothiazolyl)-5-pent-4-yn-2-yl-1,3,5-triazinan-2-one IUPAC Name: 1-butyl-3-(3-butyl-4-propyl-1,2-thiazol-5-yl)-5-pent-4-yn-2-yl-1,3,5-triazinan-2-one Traditional Name: 1-butyl-3-(3-butyl-4-propyl-isothiazol-5-yl)-5-(1-methylbut-3-ynyl)-1,3,5-triazinan-2-one Formula: C22H36N4OS MolecularWeight: 404.61244

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NSC(=C1CCC)N2CN(CN(C2=O)CCCC)C(C)CC#C

Isomeric SMILES

CCCCC1=NSC(=C1CCC)N2CN(CN(C2=O)CCCC)C(C)CC#C

InChI

InChI=1S/C22H36N4OS/c1-6-10-14-20-19(13-9-4)21(28-23-20)26-17-25(18(5)12-8-3)16-24(22(26)27)15-11-7-2/h3,18H,6-7,9-17H2,1-2,4-5H3