2,3-dimethyl-6,7-bis(3-nitrophenyl)-[1,3]thiazolo[3,2-a]pyridin-4-ium

Systemtic Name: 2,3-dimethyl-6,7-bis(3-nitrophenyl)-[1,3]thiazolo[3,2-a]pyridin-4-ium Openeye Name: 2,3-dimethyl-6,7-bis(3-nitrophenyl)thiazolo[3,2-a]pyridin-4-ium CAS Name: 2,3-dimethyl-6,7-bis(3-nitrophenyl)thiazolo[3,2-a]pyridin-4-ium IUPAC Name: 2,3-dimethyl-6,7-bis(3-nitrophenyl)-[1,3]thiazolo[3,2-a]pyridin-4-ium Traditional Name: 2,3-dimethyl-6,7-bis(3-nitrophenyl)thiazolo[3,2-a]pyridin-4-ium Formula: C21H16N3O4S+ MolecularWeight: 406.43444

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=[N+]1C=C(C(=C2)C3=CC(=CC=C3)[N+](=O)[O-])C4=CC(=CC=C4)[N+](=O)[O-])C

Isomeric SMILES

CC1=C(SC2=[N+]1C=C(C(=C2)C3=CC(=CC=C3)[N+](=O)[O-])C4=CC(=CC=C4)[N+](=O)[O-])C

InChI

InChI=1S/C21H16N3O4S/c1-13-14(2)29-21-11-19(15-5-3-7-17(9-15)23(25)26)20(12-22(13)21)16-6-4-8-18(10-16)24(27)28/h3-12H,1-2H3/q+1