N-[4,6-bis(fluoranyl)-3-prop-2-enyl-1,3-benzothiazol-2-ylidene]-5-nitro-1-benzothiophene-2-carboxamide

Systemtic Name: N-[4,6-bis(fluoranyl)-3-prop-2-enyl-1,3-benzothiazol-2-ylidene]-5-nitro-1-benzothiophene-2-carboxamide Openeye Name: N-(3-allyl-4,6-difluoro-1,3-benzothiazol-2-ylidene)-5-nitro-benzothiophene-2-carboxamide CAS Name: N-(4,6-difluoro-3-prop-2-enyl-1,3-benzothiazol-2-ylidene)-5-nitro-1-benzothiophene-2-carboxamide IUPAC Name: N-(4,6-difluoro-3-prop-2-enyl-1,3-benzothiazol-2-ylidene)-5-nitro-1-benzothiophene-2-carboxamide Traditional Name: N-(3-allyl-4,6-difluoro-1,3-benzothiazol-2-ylidene)-5-nitro-benzothiophene-2-carboxamide Formula: C19H11F2N3O3S2 MolecularWeight: 431.435746

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C2=C(C=C(C=C2SC1=NC(=O)C3=CC4=C(S3)C=CC(=C4)[N+](=O)[O-])F)F

Isomeric SMILES

C=CCN1C2=C(C=C(C=C2SC1=NC(=O)C3=CC4=C(S3)C=CC(=C4)[N+](=O)[O-])F)F

InChI

InChI=1S/C19H11F2N3O3S2/c1-2-5-23-17-13(21)8-11(20)9-15(17)29-19(23)22-18(25)16-7-10-6-12(24(26)27)3-4-14(10)28-16/h2-4,6-9H,1,5H2