2-(5-methyl-4-phenyl-1,3-thiazol-2-yl)-4-nitro-isoindole-1,3-dione

Systemtic Name: 2-(5-methyl-4-phenyl-1,3-thiazol-2-yl)-4-nitro-isoindole-1,3-dione Openeye Name: 2-(5-methyl-4-phenyl-thiazol-2-yl)-4-nitro-isoindoline-1,3-dione CAS Name: 2-(5-methyl-4-phenyl-2-thiazolyl)-4-nitroisoindole-1,3-dione IUPAC Name: 2-(5-methyl-4-phenyl-1,3-thiazol-2-yl)-4-nitroisoindole-1,3-dione Traditional Name: 2-(5-methyl-4-phenyl-thiazol-2-yl)-4-nitro-isoindoline-1,3-quinone Formula: C18H11N3O4S MolecularWeight: 365.36264

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(S1)N2C(=O)C3=C(C2=O)C(=CC=C3)[N+](=O)[O-])C4=CC=CC=C4

Isomeric SMILES

CC1=C(N=C(S1)N2C(=O)C3=C(C2=O)C(=CC=C3)[N+](=O)[O-])C4=CC=CC=C4

InChI

InChI=1S/C18H11N3O4S/c1-10-15(11-6-3-2-4-7-11)19-18(26-10)20-16(22)12-8-5-9-13(21(24)25)14(12)17(20)23/h2-9H,1H3