(5Z)-5-[(2-methoxy-5-nitro-phenyl)methylidene]-1-(phenylmethyl)-2-sulfanylidene-1,3-diazinane-4,6-dione

Systemtic Name: (5Z)-5-[(2-methoxy-5-nitro-phenyl)methylidene]-1-(phenylmethyl)-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: (5Z)-1-benzyl-5-[(2-methoxy-5-nitro-phenyl)methylene]-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: (5Z)-5-[(2-methoxy-5-nitrophenyl)methylidene]-1-(phenylmethyl)-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: (5Z)-1-benzyl-5-[(2-methoxy-5-nitrophenyl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: (5Z)-1-benzyl-5-(2-methoxy-5-nitro-benzylidene)-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C19H15N3O5S MolecularWeight: 397.4045

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)[N+](=O)[O-])C=C2C(=O)NC(=S)N(C2=O)CC3=CC=CC=C3

Isomeric SMILES

COC1=C(C=C(C=C1)[N+](=O)[O-])/C=C\2/C(=O)NC(=S)N(C2=O)CC3=CC=CC=C3

InChI

InChI=1S/C19H15N3O5S/c1-27-16-8-7-14(22(25)26)9-13(16)10-15-17(23)20-19(28)21(18(15)24)11-12-5-3-2-4-6-12/h2-10H,11H2,1H3,(H,20,23,28)/b15-10-