4-(4-fluorophenyl)sulfanyl-N-(3-methyl-5-nitro-1,3-benzothiazol-2-ylidene)butanamide

Systemtic Name: 4-(4-fluorophenyl)sulfanyl-N-(3-methyl-5-nitro-1,3-benzothiazol-2-ylidene)butanamide Openeye Name: 4-(4-fluorophenyl)sulfanyl-N-(3-methyl-5-nitro-1,3-benzothiazol-2-ylidene)butanamide CAS Name: 4-[(4-fluorophenyl)thio]-N-(3-methyl-5-nitro-1,3-benzothiazol-2-ylidene)butanamide IUPAC Name: 4-(4-fluorophenyl)sulfanyl-N-(3-methyl-5-nitro-1,3-benzothiazol-2-ylidene)butanamide Traditional Name: 4-[(4-fluorophenyl)thio]-N-(3-methyl-5-nitro-1,3-benzothiazol-2-ylidene)butyramide Formula: C18H16FN3O3S2 MolecularWeight: 405.466343

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=CC(=C2)[N+](=O)[O-])SC1=NC(=O)CCCSC3=CC=C(C=C3)F

Isomeric SMILES

CN1C2=C(C=CC(=C2)[N+](=O)[O-])SC1=NC(=O)CCCSC3=CC=C(C=C3)F

InChI

InChI=1S/C18H16FN3O3S2/c1-21-15-11-13(22(24)25)6-9-16(15)27-18(21)20-17(23)3-2-10-26-14-7-4-12(19)5-8-14/h4-9,11H,2-3,10H2,1H3