[3-(5-cyclopropyl-1,3,4-thiadiazol-2-yl)-1-(3-ethylpent-1-yn-3-yl)-2-oxidanylidene-1,3-diazinan-4-yl] cyclopropanecarboxylate

Systemtic Name: [3-(5-cyclopropyl-1,3,4-thiadiazol-2-yl)-1-(3-ethylpent-1-yn-3-yl)-2-oxidanylidene-1,3-diazinan-4-yl] cyclopropanecarboxylate Openeye Name: [3-(5-cyclopropyl-1,3,4-thiadiazol-2-yl)-1-(1,1-diethylprop-2-ynyl)-2-oxo-hexahydropyrimidin-4-yl] cyclopropanecarboxylate CAS Name: cyclopropanecarboxylic acid [3-(5-cyclopropyl-1,3,4-thiadiazol-2-yl)-1-(3-ethylpent-1-yn-3-yl)-2-oxo-1,3-diazinan-4-yl] ester IUPAC Name: [3-(5-cyclopropyl-1,3,4-thiadiazol-2-yl)-1-(3-ethylpent-1-yn-3-yl)-2-oxo-1,3-diazinan-4-yl] cyclopropanecarboxylate Traditional Name: cyclopropanecarboxylic acid [3-(5-cyclopropyl-1,3,4-thiadiazol-2-yl)-1-(1,1-diethylprop-2-ynyl)-2-keto-hexahydropyrimidin-4-yl] ester Formula: C20H26N4O3S MolecularWeight: 402.51044

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)(C#C)N1CCC(N(C1=O)C2=NN=C(S2)C3CC3)OC(=O)C4CC4

Isomeric SMILES

CCC(CC)(C#C)N1CCC(N(C1=O)C2=NN=C(S2)C3CC3)OC(=O)C4CC4

InChI

InChI=1S/C20H26N4O3S/c1-4-20(5-2,6-3)23-12-11-15(27-17(25)14-9-10-14)24(19(23)26)18-22-21-16(28-18)13-7-8-13/h1,13-15H,5-12H2,2-3H3