8-(6-methyloct-7-yn-2-ylsulfonyl)-8aH-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one

Systemtic Name: 8-(6-methyloct-7-yn-2-ylsulfonyl)-8aH-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one Openeye Name: 8-(1,5-dimethylhept-6-ynylsulfonyl)-8aH-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one CAS Name: 8-(6-methyloct-7-yn-2-ylsulfonyl)-8aH-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one IUPAC Name: 8-(6-methyloct-7-yn-2-ylsulfonyl)-8aH-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one Traditional Name: 8-(1,5-dimethylhept-6-ynylsulfonyl)-8aH-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one Formula: C14H19N3O3S2 MolecularWeight: 341.44896

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCCC(C)S(=O)(=O)N1C=CC(=O)N2C1SC=N2)C#C

Isomeric SMILES

CC(CCCC(C)S(=O)(=O)N1C=CC(=O)N2C1SC=N2)C#C

InChI

InChI=1S/C14H19N3O3S2/c1-4-11(2)6-5-7-12(3)22(19,20)16-9-8-13(18)17-14(16)21-10-15-17/h1,8-12,14H,5-7H2,2-3H3