1-butan-2-yl-3-(3-ethyl-4-methyl-1,2-thiazol-5-yl)-5-pent-4-ynyl-1,3,5-triazinan-2-one

Systemtic Name: 1-butan-2-yl-3-(3-ethyl-4-methyl-1,2-thiazol-5-yl)-5-pent-4-ynyl-1,3,5-triazinan-2-one Openeye Name: 1-(3-ethyl-4-methyl-isothiazol-5-yl)-5-pent-4-ynyl-3-sec-butyl-1,3,5-triazinan-2-one CAS Name: 1-butan-2-yl-3-(3-ethyl-4-methyl-5-isothiazolyl)-5-pent-4-ynyl-1,3,5-triazinan-2-one IUPAC Name: 1-butan-2-yl-3-(3-ethyl-4-methyl-1,2-thiazol-5-yl)-5-pent-4-ynyl-1,3,5-triazinan-2-one Traditional Name: 1-(3-ethyl-4-methyl-isothiazol-5-yl)-5-pent-4-ynyl-3-sec-butyl-1,3,5-triazinan-2-one Formula: C18H28N4OS MolecularWeight: 348.50612

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NSC(=C1C)N2CN(CN(C2=O)C(C)CC)CCCC#C

Isomeric SMILES

CCC1=NSC(=C1C)N2CN(CN(C2=O)C(C)CC)CCCC#C

InChI

InChI=1S/C18H28N4OS/c1-6-9-10-11-20-12-21(14(4)7-2)18(23)22(13-20)17-15(5)16(8-3)19-24-17/h1,14H,7-13H2,2-5H3