3-butoxy-N-[4-fluoranyl-3-(2-methoxyethyl)-1,3-benzothiazol-2-ylidene]benzamide

Systemtic Name: 3-butoxy-N-[4-fluoranyl-3-(2-methoxyethyl)-1,3-benzothiazol-2-ylidene]benzamide Openeye Name: 3-butoxy-N-[4-fluoro-3-(2-methoxyethyl)-1,3-benzothiazol-2-ylidene]benzamide CAS Name: 3-butoxy-N-[4-fluoro-3-(2-methoxyethyl)-1,3-benzothiazol-2-ylidene]benzamide IUPAC Name: 3-butoxy-N-[4-fluoro-3-(2-methoxyethyl)-1,3-benzothiazol-2-ylidene]benzamide Traditional Name: 3-butoxy-N-[4-fluoro-3-(2-methoxyethyl)-1,3-benzothiazol-2-ylidene]benzamide Formula: C21H23FN2O3S MolecularWeight: 402.482323

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=CC(=C1)C(=O)N=C2N(C3=C(C=CC=C3S2)F)CCOC

Isomeric SMILES

CCCCOC1=CC=CC(=C1)C(=O)N=C2N(C3=C(C=CC=C3S2)F)CCOC

InChI

InChI=1S/C21H23FN2O3S/c1-3-4-12-27-16-8-5-7-15(14-16)20(25)23-21-24(11-13-26-2)19-17(22)9-6-10-18(19)28-21/h5-10,14H,3-4,11-13H2,1-2H3