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

Systemtic Name: 6-[[(2-morpholin-4-yl-1,3-benzothiazol-6-yl)amino]methylidene]-4-nitro-cyclohexa-2,4-dien-1-one Openeye Name: 6-[[(2-morpholino-1,3-benzothiazol-6-yl)amino]methylene]-4-nitro-cyclohexa-2,4-dien-1-one CAS Name: 6-[[[2-(4-morpholinyl)-1,3-benzothiazol-6-yl]amino]methylidene]-4-nitro-1-cyclohexa-2,4-dienone IUPAC Name: 6-[[(2-morpholin-4-yl-1,3-benzothiazol-6-yl)amino]methylidene]-4-nitrocyclohexa-2,4-dien-1-one Traditional Name: 6-[[(2-morpholino-1,3-benzothiazol-6-yl)amino]methylene]-4-nitro-cyclohexa-2,4-dien-1-one Formula: C18H16N4O4S MolecularWeight: 384.40904

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=NC3=C(S2)C=C(C=C3)NC=C4C=C(C=CC4=O)[N+](=O)[O-]

Isomeric SMILES

C1COCCN1C2=NC3=C(S2)C=C(C=C3)NC=C4C=C(C=CC4=O)[N+](=O)[O-]

InChI

InChI=1S/C18H16N4O4S/c23-16-4-2-14(22(24)25)9-12(16)11-19-13-1-3-15-17(10-13)27-18(20-15)21-5-7-26-8-6-21/h1-4,9-11,19H,5-8H2