N-[3-(dimethylamino)propyl]-3-ethylsulfanyl-N-(6-fluoranyl-1,3-benzothiazol-2-yl)benzamide

Systemtic Name: N-[3-(dimethylamino)propyl]-3-ethylsulfanyl-N-(6-fluoranyl-1,3-benzothiazol-2-yl)benzamide Openeye Name: N-[3-(dimethylamino)propyl]-3-ethylsulfanyl-N-(6-fluoro-1,3-benzothiazol-2-yl)benzamide CAS Name: N-[3-(dimethylamino)propyl]-3-(ethylthio)-N-(6-fluoro-1,3-benzothiazol-2-yl)benzamide IUPAC Name: N-[3-(dimethylamino)propyl]-3-ethylsulfanyl-N-(6-fluoro-1,3-benzothiazol-2-yl)benzamide Traditional Name: N-[3-(dimethylamino)propyl]-3-(ethylthio)-N-(6-fluoro-1,3-benzothiazol-2-yl)benzamide Formula: C21H24FN3OS2 MolecularWeight: 417.563163

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=CC=CC(=C1)C(=O)N(CCCN(C)C)C2=NC3=C(S2)C=C(C=C3)F

Isomeric SMILES

CCSC1=CC=CC(=C1)C(=O)N(CCCN(C)C)C2=NC3=C(S2)C=C(C=C3)F

InChI

InChI=1S/C21H24FN3OS2/c1-4-27-17-8-5-7-15(13-17)20(26)25(12-6-11-24(2)3)21-23-18-10-9-16(22)14-19(18)28-21/h5,7-10,13-14H,4,6,11-12H2,1-3H3