6-[[(6-methyl-1,3-benzothiazol-2-yl)amino]methylidene]-2,4-dinitro-cyclohexa-2,4-dien-1-one

Systemtic Name: 6-[[(6-methyl-1,3-benzothiazol-2-yl)amino]methylidene]-2,4-dinitro-cyclohexa-2,4-dien-1-one Openeye Name: 6-[[(6-methyl-1,3-benzothiazol-2-yl)amino]methylene]-2,4-dinitro-cyclohexa-2,4-dien-1-one CAS Name: 6-[[(6-methyl-1,3-benzothiazol-2-yl)amino]methylidene]-2,4-dinitro-1-cyclohexa-2,4-dienone IUPAC Name: 6-[[(6-methyl-1,3-benzothiazol-2-yl)amino]methylidene]-2,4-dinitrocyclohexa-2,4-dien-1-one Traditional Name: 6-[[(6-methyl-1,3-benzothiazol-2-yl)amino]methylene]-2,4-dinitro-cyclohexa-2,4-dien-1-one Formula: C15H10N4O5S MolecularWeight: 358.3287

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(S2)NC=C3C=C(C=C(C3=O)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(S2)NC=C3C=C(C=C(C3=O)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C15H10N4O5S/c1-8-2-3-11-13(4-8)25-15(17-11)16-7-9-5-10(18(21)22)6-12(14(9)20)19(23)24/h2-7H,1H3,(H,16,17)