N-(5,6-dimethyl-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-3-(4-fluorophenyl)sulfanyl-propanamide

Systemtic Name: N-(5,6-dimethyl-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-3-(4-fluorophenyl)sulfanyl-propanamide Openeye Name: N-(5,6-dimethyl-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-3-(4-fluorophenyl)sulfanyl-propanamide CAS Name: N-(5,6-dimethyl-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-3-[(4-fluorophenyl)thio]propanamide IUPAC Name: N-(5,6-dimethyl-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-3-(4-fluorophenyl)sulfanylpropanamide Traditional Name: N-(5,6-dimethyl-3-propargyl-1,3-benzothiazol-2-ylidene)-3-[(4-fluorophenyl)thio]propionamide Formula: C21H19FN2OS2 MolecularWeight: 398.516763

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1C)SC(=NC(=O)CCSC3=CC=C(C=C3)F)N2CC#C

Isomeric SMILES

CC1=CC2=C(C=C1C)SC(=NC(=O)CCSC3=CC=C(C=C3)F)N2CC#C

InChI

InChI=1S/C21H19FN2OS2/c1-4-10-24-18-12-14(2)15(3)13-19(18)27-21(24)23-20(25)9-11-26-17-7-5-16(22)6-8-17/h1,5-8,12-13H,9-11H2,2-3H3