7-methyl-2-[(6-propan-2-yl-3,4-dihydro-2H-quinolin-1-yl)methyl]-8H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-4-ium-5-one

Systemtic Name: 7-methyl-2-[(6-propan-2-yl-3,4-dihydro-2H-quinolin-1-yl)methyl]-8H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-4-ium-5-one Openeye Name: 2-[(6-isopropyl-3,4-dihydro-2H-quinolin-1-yl)methyl]-7-methyl-8H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-4-ium-5-one CAS Name: 7-methyl-2-[(6-propan-2-yl-3,4-dihydro-2H-quinolin-1-yl)methyl]-8H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-4-ium-5-one IUPAC Name: 7-methyl-2-[(6-propan-2-yl-3,4-dihydro-2H-quinolin-1-yl)methyl]-8H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-4-ium-5-one Traditional Name: 2-[(6-isopropyl-3,4-dihydro-2H-quinolin-1-yl)methyl]-7-methyl-8H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-4-ium-5-one Formula: C19H23N4OS+ MolecularWeight: 355.47712

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)[N+]2=C(N1)SC(=N2)CN3CCCC4=C3C=CC(=C4)C(C)C

Isomeric SMILES

CC1=CC(=O)[N+]2=C(N1)SC(=N2)CN3CCCC4=C3C=CC(=C4)C(C)C

InChI

InChI=1S/C19H22N4OS/c1-12(2)14-6-7-16-15(10-14)5-4-8-22(16)11-17-21-23-18(24)9-13(3)20-19(23)25-17/h6-7,9-10,12H,4-5,8,11H2,1-3H3/p+1