N-[(2Z)-2-[4-(3-nitrophenyl)-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene]-4-(3-sulfanylidenecyclohexa-1,5-dien-1-yl)-3H-1,3-oxazol-5-yl]pentanamide

Systemtic Name: N-[(2Z)-2-[4-(3-nitrophenyl)-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene]-4-(3-sulfanylidenecyclohexa-1,5-dien-1-yl)-3H-1,3-oxazol-5-yl]pentanamide Openeye Name: N-[(2Z)-2-[4-(3-nitrophenyl)-6-oxo-cyclohexa-2,4-dien-1-ylidene]-4-(3-thioxocyclohexa-1,5-dien-1-yl)-3H-oxazol-5-yl]pentanamide CAS Name: N-[(2Z)-2-[4-(3-nitrophenyl)-6-oxo-1-cyclohexa-2,4-dienylidene]-4-(3-sulfanylidene-1-cyclohexa-1,5-dienyl)-3H-oxazol-5-yl]pentanamide IUPAC Name: N-[(2Z)-2-[4-(3-nitrophenyl)-6-oxocyclohexa-2,4-dien-1-ylidene]-4-(3-sulfanylidenecyclohexa-1,5-dien-1-yl)-3H-1,3-oxazol-5-yl]pentanamide Traditional Name: N-[(2Z)-2-[6-keto-4-(3-nitrophenyl)cyclohexa-2,4-dien-1-ylidene]-4-(3-thioxocyclohexa-1,5-dien-1-yl)-4-oxazolin-5-yl]valeramide Formula: C26H23N3O5S MolecularWeight: 489.54292

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)NC1=C(NC(=C2C=CC(=CC2=O)C3=CC(=CC=C3)[N+](=O)[O-])O1)C4=CC(=S)CC=C4

Isomeric SMILES

CCCCC(=O)NC1=C(N/C(=C/2\C=CC(=CC2=O)C3=CC(=CC=C3)[N+](=O)[O-])/O1)C4=CC(=S)CC=C4

InChI

InChI=1S/C26H23N3O5S/c1-2-3-10-23(31)27-26-24(18-7-5-9-20(35)14-18)28-25(34-26)21-12-11-17(15-22(21)30)16-6-4-8-19(13-16)29(32)33/h4-8,11-15,28H,2-3,9-10H2,1H3,(H,27,31)/b25-21-