1-(4-methoxyphenyl)-5-[(6-nitro-1,3-benzothiazol-2-yl)hydrazinylidene]-3-phenyl-2-sulfanylidene-1,3-diazinane-4,6-dione

Systemtic Name: 1-(4-methoxyphenyl)-5-[(6-nitro-1,3-benzothiazol-2-yl)hydrazinylidene]-3-phenyl-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: 1-(4-methoxyphenyl)-5-[(6-nitro-1,3-benzothiazol-2-yl)hydrazono]-3-phenyl-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: 1-(4-methoxyphenyl)-5-[(6-nitro-1,3-benzothiazol-2-yl)hydrazinylidene]-3-phenyl-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: 1-(4-methoxyphenyl)-5-[(6-nitro-1,3-benzothiazol-2-yl)hydrazinylidene]-3-phenyl-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: 1-(4-methoxyphenyl)-5-[(6-nitro-1,3-benzothiazol-2-yl)hydrazono]-3-phenyl-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C24H16N6O5S2 MolecularWeight: 532.55104

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2C(=O)C(=NNC3=NC4=C(S3)C=C(C=C4)[N+](=O)[O-])C(=O)N(C2=S)C5=CC=CC=C5

Isomeric SMILES

COC1=CC=C(C=C1)N2C(=O)C(=NNC3=NC4=C(S3)C=C(C=C4)[N+](=O)[O-])C(=O)N(C2=S)C5=CC=CC=C5

InChI

InChI=1S/C24H16N6O5S2/c1-35-17-10-7-15(8-11-17)29-22(32)20(21(31)28(24(29)36)14-5-3-2-4-6-14)26-27-23-25-18-12-9-16(30(33)34)13-19(18)37-23/h2-13H,1H3,(H,25,27)