3-(4-fluorophenyl)sulfanyl-N-[3-(2-methoxyethyl)-5-nitro-1,3-benzothiazol-2-ylidene]propanamide

Systemtic Name: 3-(4-fluorophenyl)sulfanyl-N-[3-(2-methoxyethyl)-5-nitro-1,3-benzothiazol-2-ylidene]propanamide Openeye Name: 3-(4-fluorophenyl)sulfanyl-N-[3-(2-methoxyethyl)-5-nitro-1,3-benzothiazol-2-ylidene]propanamide CAS Name: 3-[(4-fluorophenyl)thio]-N-[3-(2-methoxyethyl)-5-nitro-1,3-benzothiazol-2-ylidene]propanamide IUPAC Name: 3-(4-fluorophenyl)sulfanyl-N-[3-(2-methoxyethyl)-5-nitro-1,3-benzothiazol-2-ylidene]propanamide Traditional Name: 3-[(4-fluorophenyl)thio]-N-[3-(2-methoxyethyl)-5-nitro-1,3-benzothiazol-2-ylidene]propionamide Formula: C19H18FN3O4S2 MolecularWeight: 435.492323

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Descriptors Computed from Structure

Canonical SMILES:

COCCN1C2=C(C=CC(=C2)[N+](=O)[O-])SC1=NC(=O)CCSC3=CC=C(C=C3)F

Isomeric SMILES

COCCN1C2=C(C=CC(=C2)[N+](=O)[O-])SC1=NC(=O)CCSC3=CC=C(C=C3)F

InChI

InChI=1S/C19H18FN3O4S2/c1-27-10-9-22-16-12-14(23(25)26)4-7-17(16)29-19(22)21-18(24)8-11-28-15-5-2-13(20)3-6-15/h2-7,12H,8-11H2,1H3