[3-(5-cyclobutyl-1,3,4-thiadiazol-2-yl)-1-(4-ethynylheptan-4-yl)-2-oxidanylidene-1,3-diazinan-4-yl] cyclobutanecarboxylate

Systemtic Name: [3-(5-cyclobutyl-1,3,4-thiadiazol-2-yl)-1-(4-ethynylheptan-4-yl)-2-oxidanylidene-1,3-diazinan-4-yl] cyclobutanecarboxylate Openeye Name: [3-(5-cyclobutyl-1,3,4-thiadiazol-2-yl)-1-(1-ethynyl-1-propyl-butyl)-2-oxo-hexahydropyrimidin-4-yl] cyclobutanecarboxylate CAS Name: cyclobutanecarboxylic acid [3-(5-cyclobutyl-1,3,4-thiadiazol-2-yl)-1-(4-ethynylheptan-4-yl)-2-oxo-1,3-diazinan-4-yl] ester IUPAC Name: [3-(5-cyclobutyl-1,3,4-thiadiazol-2-yl)-1-(4-ethynylheptan-4-yl)-2-oxo-1,3-diazinan-4-yl] cyclobutanecarboxylate Traditional Name: cyclobutanecarboxylic acid [3-(5-cyclobutyl-1,3,4-thiadiazol-2-yl)-1-(1,1-dipropylprop-2-ynyl)-2-keto-hexahydropyrimidin-4-yl] ester Formula: C24H34N4O3S MolecularWeight: 458.61676

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(CCC)(C#C)N1CCC(N(C1=O)C2=NN=C(S2)C3CCC3)OC(=O)C4CCC4

Isomeric SMILES

CCCC(CCC)(C#C)N1CCC(N(C1=O)C2=NN=C(S2)C3CCC3)OC(=O)C4CCC4

InChI

InChI=1S/C24H34N4O3S/c1-4-14-24(6-3,15-5-2)27-16-13-19(31-21(29)18-11-8-12-18)28(23(27)30)22-26-25-20(32-22)17-9-7-10-17/h3,17-19H,4-5,7-16H2,1-2H3