5-methyl-7-(4-nitrophenyl)-2,3-dihydro-[1,3]thiazolo[3,2-c]pyrimidin-4-ium-8-olate

Systemtic Name: 5-methyl-7-(4-nitrophenyl)-2,3-dihydro-[1,3]thiazolo[3,2-c]pyrimidin-4-ium-8-olate Openeye Name: 5-methyl-7-(4-nitrophenyl)-2,3-dihydrothiazolo[3,2-c]pyrimidin-4-ium-8-olate CAS Name: 5-methyl-7-(4-nitrophenyl)-2,3-dihydrothiazolo[3,2-c]pyrimidin-4-ium-8-olate IUPAC Name: 5-methyl-7-(4-nitrophenyl)-2,3-dihydro-[1,3]thiazolo[3,2-c]pyrimidin-4-ium-8-olate Traditional Name: 5-methyl-7-(4-nitrophenyl)-2,3-dihydrothiazolo[3,2-c]pyrimidin-4-ium-8-olate Formula: C13H11N3O3S MolecularWeight: 289.30974

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(C2=[N+]1CCS2)[O-])C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=NC(=C(C2=[N+]1CCS2)[O-])C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C13H11N3O3S/c1-8-14-11(12(17)13-15(8)6-7-20-13)9-2-4-10(5-3-9)16(18)19/h2-5H,6-7H2,1H3