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

Systemtic Name: [3-(5-tert-butyl-1,3,4-thiadiazol-2-yl)-1-methyl-1,3-diazinan-4-yl] but-3-ynoate Openeye Name: [3-(5-tert-butyl-1,3,4-thiadiazol-2-yl)-1-methyl-hexahydropyrimidin-4-yl] but-3-ynoate CAS Name: 3-butynoic acid [3-(5-tert-butyl-1,3,4-thiadiazol-2-yl)-1-methyl-1,3-diazinan-4-yl] ester IUPAC Name: [3-(5-tert-butyl-1,3,4-thiadiazol-2-yl)-1-methyl-1,3-diazinan-4-yl] but-3-ynoate Traditional Name: but-3-ynoic acid [3-(5-tert-butyl-1,3,4-thiadiazol-2-yl)-1-methyl-hexahydropyrimidin-4-yl] ester Formula: C15H22N4O2S MolecularWeight: 322.42578

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NN=C(S1)N2CN(CCC2OC(=O)CC#C)C

Isomeric SMILES

CC(C)(C)C1=NN=C(S1)N2CN(CCC2OC(=O)CC#C)C

InChI

InChI=1S/C15H22N4O2S/c1-6-7-12(20)21-11-8-9-18(5)10-19(11)14-17-16-13(22-14)15(2,3)4/h1,11H,7-10H2,2-5H3