3-(4-fluorophenyl)sulfonyl-N-(5-nitro-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)propanamide

Systemtic Name: 3-(4-fluorophenyl)sulfonyl-N-(5-nitro-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)propanamide Openeye Name: 3-(4-fluorophenyl)sulfonyl-N-(5-nitro-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)propanamide CAS Name: 3-(4-fluorophenyl)sulfonyl-N-(5-nitro-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)propanamide IUPAC Name: 3-(4-fluorophenyl)sulfonyl-N-(5-nitro-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)propanamide Traditional Name: 3-(4-fluorophenyl)sulfonyl-N-(5-nitro-3-propargyl-1,3-benzothiazol-2-ylidene)propionamide Formula: C19H14FN3O5S2 MolecularWeight: 447.459963

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Descriptors Computed from Structure

Canonical SMILES:

C#CCN1C2=C(C=CC(=C2)[N+](=O)[O-])SC1=NC(=O)CCS(=O)(=O)C3=CC=C(C=C3)F

Isomeric SMILES

C#CCN1C2=C(C=CC(=C2)[N+](=O)[O-])SC1=NC(=O)CCS(=O)(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C19H14FN3O5S2/c1-2-10-22-16-12-14(23(25)26)5-8-17(16)29-19(22)21-18(24)9-11-30(27,28)15-6-3-13(20)4-7-15/h1,3-8,12H,9-11H2