[3-(5-butyl-1,3,4-thiadiazol-2-yl)-1-methyl-2-oxidanylidene-1,3-diazinan-4-yl] hex-4-ynoate

Systemtic Name: [3-(5-butyl-1,3,4-thiadiazol-2-yl)-1-methyl-2-oxidanylidene-1,3-diazinan-4-yl] hex-4-ynoate Openeye Name: [3-(5-butyl-1,3,4-thiadiazol-2-yl)-1-methyl-2-oxo-hexahydropyrimidin-4-yl] hex-4-ynoate CAS Name: 4-hexynoic acid [3-(5-butyl-1,3,4-thiadiazol-2-yl)-1-methyl-2-oxo-1,3-diazinan-4-yl] ester IUPAC Name: [3-(5-butyl-1,3,4-thiadiazol-2-yl)-1-methyl-2-oxo-1,3-diazinan-4-yl] hex-4-ynoate Traditional Name: hex-4-ynoic acid [3-(5-butyl-1,3,4-thiadiazol-2-yl)-2-keto-1-methyl-hexahydropyrimidin-4-yl] ester Formula: C17H24N4O3S MolecularWeight: 364.46246

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NN=C(S1)N2C(CCN(C2=O)C)OC(=O)CCC#CC

Isomeric SMILES

CCCCC1=NN=C(S1)N2C(CCN(C2=O)C)OC(=O)CCC#CC

InChI

InChI=1S/C17H24N4O3S/c1-4-6-8-10-15(22)24-14-11-12-20(3)17(23)21(14)16-19-18-13(25-16)9-7-5-2/h14H,5,7-12H2,1-3H3